SCHEMBL22076430

SCHEMBL22076430

CCC(=O)Oc1cc(OC(=O)CC)c2c(=O)c(O)c(-c3ccc(OC(=O)CC)c(OC(=O)CC)c3)oc2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.59
▸ KDM4E B2RXH2 4/20 0.59
▸ CYP3A4 P08684 4/20 0.59
▸ CASP1 P29466 2/20 0.59
▸ CASP7 P55210 2/20 0.59
▸ LMNA P02545 2/20 0.59
▸ TP53 P04637 2/20 0.59
▸ ABCG2 Q9UNQ0 3/20 0.53
▸ XDH P47989 2/20 0.50
▸ DPP4 P27487 1/20 0.50
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ HSD17B10 Q99714 2/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ IPMK Q8NFU5 2/20 0.47
▸ IP6K2 Q9UHH9 2/20 0.47
▸ TDP1 Q9NUW8 2/20 0.47
▸ APP P05067 1/20 0.47
▸ THRB P10828 1/20 0.47

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
SCHEMBL20581904 0.89 ADORA3 (0.54) MAPTKDM4ECYP3A4CASP1CASP7
SCHEMBL15965556 0.85 KDM4E (0.66) MAPTKDM4ECYP3A4CASP1CASP7
SCHEMBL24344965 0.85 KDM4E (0.50) MAPTKDM4ECYP3A4CASP1CASP7
SCHEMBL15456981 0.81 KDM4E (0.57) MAPTKDM4ECYP3A4CASP1CASP7
SCHEMBL28948784 0.81 MEN1 (0.71) MAPTKDM4ECYP3A4LMNATP53
SCHEMBL20581791 0.81 KDM4E (0.73) MAPTKDM4ECYP3A4CASP1CASP7
SCHEMBL20581913 0.81 ADORA3 (0.53) MAPTKDM4ECYP3A4CASP1CASP7
SCHEMBL11098925 0.80 ABCG2 (0.72) MAPTKDM4ECYP3A4CASP1CASP7
SCHEMBL22076468 0.80 ADORA3 (0.59) KDM4ECYP3A4ABCG2MEN1KMT2A
SCHEMBL23117590 0.79 ADORA3 (0.51) MAPTKDM4ECYP3A4CASP1CASP7

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 8 patents. 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-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
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-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 (5 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 MAPT 4528/4885KDM4E 2430/4885CYP3A4 4519/4885
US-20210283157-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS ENPP2, MBOAT7, AADAC MAPT 4528/4885KDM4E 2430/4885CYP3A4 4519/4885
US-20220110960-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS ENPP2, MBOAT7, AADAC MAPT 4528/4885KDM4E 2430/4885CYP3A4 4519/4885
US-20200188418-A1 ACYLATED ACTIVE AGENTS AND METHODS OF THEIR USE FOR THE TREATMENT OF AUTOIMMUNE DISORDERS ENPP2, MBOAT7, AADAC MAPT 4528/4885KDM4E 2430/4885CYP3A4 4519/4885
US-12115178-B2 Acylated active agents and methods of their use for the treatment of autoimmune disorders ENPP2, MBOAT7, AADAC MAPT 4528/4885KDM4E 2430/4885CYP3A4 4519/4885

“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.

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