SCHEMBL22076402

SCHEMBL22076402

CCC(=O)Oc1ccc(-c2cc(=O)c3c(OC(=O)CC)cc(OC(=O)CC)cc3o2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.69
ACHE P22303 4/20 0.69
KDM4E B2RXH2 3/20 0.64
CYP3A4 P08684 3/20 0.64
MAPT P10636 2/20 0.64
HSD17B10 Q99714 2/20 0.64
ALDH1A1 P00352 2/20 0.64
HPGD P15428 2/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
MEN1 O00255 1/20 0.59
ALOX12 P18054 1/20 0.59
MAPK1 P28482 1/20 0.59
CASP1 P29466 1/20 0.59
CASP7 P55210 1/20 0.59
KMT2A Q03164 1/20 0.59
ABCB1 P08183 1/20 0.56
KCNA5 P22460 1/20 0.54
KCNH2 Q12809 1/20 0.54
CYP1A2 P05177 1/20 0.53
POLB P06746 1/20 0.53

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22076347 0.91 BCHE (0.66) BCHEACHEKDM4ECYP3A4MAPT
SCHEMBL20581791 0.91 KDM4E (0.73) BCHEACHEKDM4ECYP3A4MAPT
SCHEMBL22076462 0.88 BCHE (0.72) BCHEACHECYP3A4MAPTALDH1A1
SCHEMBL23620834 0.84 KDM4E (0.55) BCHEACHEKDM4ECYP3A4MAPT
Apigenin Triacetate SCHEMBL1676023 0.84 KDM4E (0.88) BCHEACHEKDM4ECYP3A4MAPT
SCHEMBL23620836 0.83 KDM4E (0.57) BCHEACHEKDM4ECYP3A4MAPT
SCHEMBL22107685 0.81 MEN1 (0.60) BCHEACHEKDM4ECYP3A4MAPT
SCHEMBL22076515 0.81 KDM4E (0.70) BCHEACHEKDM4ECYP3A4MAPT
SCHEMBL22076468 0.80 ADORA3 (0.59) BCHEACHEKDM4ECYP3A4ALDH1A1
SCHEMBL17138137 0.80 BCHE (0.58) BCHEACHEKDM4ECYP3A4MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12115178-B2 Acylated active agents and methods of their use for the treatment of autoimmune disorders FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2024-10-15 US disclosed
US-20240180941-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE FLAGSHIP PIONEERING INNOVATIONS V INC (US) 2024-06-06 US disclosed
US-11813272-B2 Active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2023-11-14 US disclosed
US-11813272-B2 Active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2023-11-14 US disclosed
US-11813272-B2 Active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2023-11-14 US disclosed
US-20220110960-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS FLAGSHIP PIONEERING INNOVATIONS V, INC. 2022-04-14 US disclosed
US-20220110960-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS FLAGSHIP PIONEERING INNOVATIONS V, INC. 2022-04-14 US disclosed
US-20210283157-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS SENDA BIOSCIENCES, INC. 2021-09-16 US disclosed
US-20210283157-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS SENDA BIOSCIENCES, INC. 2021-09-16 US disclosed
US-11058698-B2 Acylated active agents and methods of their use for the treatment of autoimmune disorders FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2021-07-13 US disclosed
US-20210177877-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2021-06-17 US disclosed
EP-3801496-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE Flagship Pioneering Innovations V, Inc. (US) 2021-04-14 EP disclosed
EP-3801489-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS Flagship Pioneering Innovations V, Inc. (US) 2021-04-14 EP disclosed
US-10953027-B2 Active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2021-03-23 US disclosed
US-10953027-B2 Active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease FLAGSHIP PIONEERING INNOVATIONS V, INC. (US) 2021-03-23 US disclosed
CN-112367987-A Active agents and methods for their use in treating metabolic disorders and non-alcoholic fatty liver disease 旗舰创业创新五公司 2021-02-12 CN disclosed
US-20200197428-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE FLAGSHIP PIONEERING, INC. 2020-06-25 US disclosed
US-20200197428-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE FLAGSHIP PIONEERING, INC. 2020-06-25 US disclosed
US-20200188418-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS SENDA BIOSCIENCES, INC. 2020-06-18 US disclosed
US-20200188418-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS SENDA BIOSCIENCES, INC. 2020-06-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11058698-B2 Acylated active agents and methods of their use for the treatment of autoimmune disorders ENPP2, MBOAT7, AADAC BCHE 901/4885ACHE 1525/4885KDM4E 2430/4885
US-11813272-B2 Active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease FABP1, PYGL, LIPC BCHE 655/4885ACHE 2189/4885KDM4E 4251/4885
US-20240180941-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE FABP1, PYGL, LIPC BCHE 655/4885ACHE 2189/4885KDM4E 4251/4885
US-20210283157-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS ENPP2, MBOAT7, AADAC BCHE 901/4885ACHE 1525/4885KDM4E 2430/4885
US-20220110960-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS ENPP2, MBOAT7, AADAC BCHE 901/4885ACHE 1525/4885KDM4E 2430/4885
US-20200188418-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS ENPP2, MBOAT7, AADAC BCHE 901/4885ACHE 1525/4885KDM4E 2430/4885
US-12115178-B2 Acylated active agents and methods of their use for the treatment of autoimmune disorders ENPP2, MBOAT7, AADAC BCHE 901/4885ACHE 1525/4885KDM4E 2430/4885
US-20200197428-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE FABP1, PYGL, LIPC BCHE 655/4885ACHE 2189/4885KDM4E 4251/4885
US-20210177877-A1 ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS AND NONALCOHOLIC FATTY LIVER DISEASE FABP1, PYGL, LIPC BCHE 655/4885ACHE 2189/4885KDM4E 4251/4885
US-10953027-B2 Active agents and methods of their use for the treatment of metabolic disorders and nonalcoholic fatty liver disease FABP1, PYGL, LIPC BCHE 655/4885ACHE 2189/4885KDM4E 4251/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.