Sugi Predict

Sugi Predict / Compounds / SCHEMBL359762

SCHEMBL359762

SCHEMBL359762

CC(=O)Nc1cccc(OC(C)=O)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.71
▸ KMT2A Q03164 2/20 0.71
▸ RAB9A P51151 3/20 0.64
▸ ALDH1A1 P00352 3/20 0.64
▸ HTT P42858 3/20 0.64
▸ SMN1; SMN2 Q16637 3/20 0.64
▸ NPC1 O15118 2/20 0.64
▸ TP53 P04637 1/20 0.64
▸ GAA P10253 2/20 0.62
▸ TDP1 Q9NUW8 2/20 0.59
▸ NPSR1 Q6W5P4 1/20 0.59
▸ KDM4E B2RXH2 1/20 0.59
▸ CRHBP P24387 1/20 0.59
▸ CRHR2 Q13324 1/20 0.59
▸ MAPT P10636 1/20 0.58
▸ MTNR1A P48039 1/20 0.58
▸ MTNR1B P49286 1/20 0.58
▸ LMNA P02545 2/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ CYP1A2 P05177 1/20 0.58

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
SCHEMBL28542980 0.88 MEN1 (0.69) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL5250387 0.86 MEN1 (0.61) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL26804175 0.86 GAA (0.59) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL11861880 0.85 GAA (0.58) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL29771009 0.85 KMT2A (0.66) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL25380688 0.85 KMT2A (0.66) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL16677943 0.85 KMT2A (0.91) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL17680726 0.84 CA2 (0.58) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL14338249 0.84 MTNR1B (0.69) MEN1KMT2ARAB9AALDH1A1HTT
SCHEMBL13488649 0.84 MTNR1A (0.59) MEN1KMT2ARAB9AALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998014501-A1 PROCESS FOR THE PREPARATION OF THERMOTROPIC AROMATIC POLYESTERS DIRECTLY FROM DIALKYL AROMATIC ESTERS HOECHST CELANESE CORPORATION (US) 1998-04-09 — — WO claimed
US-5731401-A ONE STEP; HIGH MOLECULAR WEIGHT HOECHST CELANESE CORP. (US) 1998-03-24 — — US claimed
US-20230046947-A1 REACTIVE CONJUGATES DEBIOPHARM RESEARCH & MANUFACTURING S.A. (CH) 2023-02-16 — — US disclosed
CN-115247192-A Enzymatic preparation technology of acyl/aroyl coenzyme A 中国医学科学院药物研究所 2022-10-28 — — CN disclosed
CN-112851538-B Method for promoting acylation of amine or alcohol by carbon dioxide 中国科学院兰州化学物理研究所 2022-05-20 — — CN disclosed
CN-112851538-A Method for promoting acylation of amine or alcohol by carbon dioxide 中国科学院兰州化学物理研究所 2021-05-28 — — CN disclosed
EP-3705477-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS Vertex Pharmaceuticals Incorporated (US) 2020-09-09 — — EP disclosed
US-10662192-B2 Modulators of ATP-binding cassette transporters VERTEX PHARMACEUTICALS INCORPORATED (US) 2020-05-26 — — US disclosed
EP-3216787-B1 INTERMEDIATES FOR THE PREPARATION OF MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMA (US) 2020-02-19 — — EP disclosed
CN-110003219-A Pyrazolo [1,5A] pyrimidine and thieno [3,2B] pyrimidine derivatives as IRAK4 regulator 弗·哈夫曼-拉罗切有限公司 2019-07-12 — — CN disclosed
US-20190144450-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-05-16 — — US disclosed
EP-0685531-B1 Monoazo dyes, their preparation and use thereof DYSTAR JAPAN LTD (JP) 1998-12-23 — — EP disclosed
WO-1998014501-A1 PROCESS FOR THE PREPARATION OF THERMOTROPIC AROMATIC POLYESTERS DIRECTLY FROM DIALKYL AROMATIC ESTERS HOECHST CELANESE CORPORATION (US) 1998-04-09 — — WO disclosed
US-5731401-A ONE STEP; HIGH MOLECULAR WEIGHT HOECHST CELANESE CORP. (US) 1998-03-24 — — US disclosed
US-5569751-A DIAZOTIZATION; COUPLING HOECHST MITSUBISHI KASEI CO. (JP) 1996-10-29 — — US disclosed
EP-0685531-A1 Monoazo dyes, their preparation and use thereof HOECHST MITSUBISHI KASEI CO., LTD. (JP) 1995-12-06 — — EP disclosed
EP-0352845-B1 A process for the preparation of aromatic thermotropic copolyesteramides,and copolyesteramides corresponding thereto. CABLES DE COMUNICACIONES, S.A. (ES) 1993-02-03 — — EP disclosed
EP-0081900-B1 ANISOTROPIC POLYMERS HAVING IMPROVED RETENTION OF PHYSICAL PROPERTIES AT ELEVATED TEMPERATURES AND METHODS OF MANUFACTURE THEREOF IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1987-05-13 — — EP disclosed
US-4499256-A Anisotropic polyesteramide polymers having improved retention of physical properties at elevated temperatures and methods of manufacture thereof IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1985-02-12 — — US disclosed
EP-0081900-A1 Anisotropic polymers having improved retention of physical properties at elevated temperatures and methods of manufacture thereof IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-06-22 — — EP 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 (3 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-20190144450-A1 MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS CFTR, ABCB1, ABCC2 MEN1 4698/4885KMT2A 4245/4885RAB9A 2557/4885
US-10662192-B2 Modulators of ATP-binding cassette transporters CFTR, ABCB1, ABCC2 MEN1 4698/4885KMT2A 4245/4885RAB9A 2557/4885
US-20230046947-A1 REACTIVE CONJUGATES FCGR3B, FCGR1A, FCGR2A MEN1 221/4885KMT2A 1155/4885RAB9A 278/4885

“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.