SCHEMBL9682203

SCHEMBL9682203

COC(=O)Cc1ccc(OC(F)(F)F)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.71
KMT2A Q03164 1/20 0.71
SMN1; SMN2 Q16637 1/20 0.71
CYP4F2 P78329 1/20 0.54
CYP4A11 Q02928 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.53
NLRP3 Q96P20 1/20 0.51
EPHX2 P34913 3/20 0.50
POLB P06746 1/20 0.50
NR1H4 Q96RI1 1/20 0.50
LTA4H P09960 1/20 0.50
LMNA P02545 1/20 0.49
HRH3 Q9Y5N1 2/20 0.49
MAPK8 P45983 1/20 0.49
MRGPRX4 Q96LA9 1/20 0.49
VNN1 O95497 2/20 0.48
NPC1 O15118 1/20 0.48
ALDH1A1 P00352 1/20 0.48
RAB9A P51151 1/20 0.48
ACACB O00763 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
SCHEMBL27237496 0.95 MEN1 (0.66) MEN1KMT2ASMN1; SMN2CYP4F2CYP4A11
SCHEMBL7502088 0.84 CYP4F2 (0.56) MEN1KMT2ASMN1; SMN2CYP4F2CYP4A11
SCHEMBL22504144 0.83 KMT2A (0.53) MEN1KMT2ASMN1; SMN2L3MBTL1EPHX2
SCHEMBL1940297 0.83 POLB (0.62) MEN1KMT2ASMN1; SMN2NLRP3EPHX2
SCHEMBL19730987 0.83 MEN1 (0.53) MEN1KMT2ASMN1; SMN2NLRP3EPHX2
SCHEMBL7983265 0.82 POLB (0.56) MEN1KMT2ASMN1; SMN2NLRP3EPHX2
SCHEMBL13329837 0.81 NLRP3 (0.57) MEN1KMT2ASMN1; SMN2L3MBTL1NLRP3
SCHEMBL4113212 0.81 CYP4F2 (0.76) KMT2ASMN1; SMN2CYP4F2CYP4A11L3MBTL1
SCHEMBL378549 0.81 VNN1 (0.52) MEN1KMT2ASMN1; SMN2MRGPRX4VNN1
SCHEMBL378766 0.80 EPHX2 (0.54) MEN1KMT2ASMN1; SMN2NLRP3EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3774805-B1 HETEROBICYCLIC INHIBITORS OF MAT2A AND METHODS OF USE FOR TREATING CANCER SERVIER LAB (FR) 2024-01-10 EP disclosed
CN-111936499-B Heterobicyclic inhibitors of MAT2A and methods for treating cancer 法国施维雅药厂 2023-09-19 CN disclosed
US-11524960-B2 Heterobicyclic inhibitors of MAT2A and methods of use for treating cancer SERVIER PHARMACEUTICALS LLC (US) 2022-12-13 US disclosed
US-20210115045-A1 HETEROBICYCLIC INHIBITORS OF MAT2A AND METHODS OF USE FOR TREATING CANCER SERVIER PHARMACEUTICALS LLC 2021-04-22 US disclosed
US-10961266-B2 Chemoselective methylene hydroxylation in aromatic molecules THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-03-30 US disclosed
EP-3774805-A1 HETEROBICYCLIC INHIBITORS OF MAT2A AND METHODS OF USE FOR TREATING CANCER Agios Pharmaceuticals, Inc. (US) 2021-02-17 EP disclosed
CN-111936499-A Heterobicyclic inhibitors of MAT2A and methods for treating cancer 安吉奥斯医药品有限公司 2020-11-13 CN disclosed
US-20200087331-A1 CHEMOSELECTIVE METHYLENE HYDROXYLATION IN AROMATIC MOLECULES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2020-03-19 US disclosed
WO-2019191470-A1 HETEROBICYCLIC INHIBITORS OF MAT2A AND METHODS OF USE FOR TREATING CANCER AGIOS PHARMACEUTICALS, INC. (US) 2019-10-03 WO disclosed
US-10017508-B2 Nitrogenated heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-07-10 US disclosed
US-20130060050-A1 PROCESS FOR PRODUCING THIOPHENE COMPOUND AND INTERMEDIATE THEREOF NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2013-03-07 US disclosed
US-20120172448-A1 Substituted 1-benzylcycloalkylcarboxylic acids and the use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-07-05 US disclosed
US-20120172448-A1 Substituted 1-benzylcycloalkylcarboxylic acids and the use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-07-05 US disclosed
US-20110124884-A1 PROCESS FOR PRODUCING THIOPHENE COMPOUND AND INTERMEDIATE THEREOF NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-05-26 US disclosed
US-20110065634-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
EP-2246343-A1 PROCESS FOR PRODUCTION OF THIOPHENE COMPOUND AND INTERMEDIATE THEREOF Nissan Chemical Industries, Ltd. (JP) 2010-11-03 EP disclosed
US-5091416-A INSECTICIDAL COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-25 US disclosed
US-5026727-A 1,1-Difluoro-2-alkyl-2-(4-trifluoromethoxy-phenyl)-3-(substituted benzyloxy) propane IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-06-25 US disclosed
EP-0361694-A2 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-04-04 EP disclosed
EP-0361695-A2 Insecticidal compounds IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-04-04 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 (9 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-20130060050-A1 PROCESS FOR PRODUCING THIOPHENE COMPOUND AND INTERMEDIATE THEREOF SULT1E1, CYP3A4, TKT MEN1 3326/4885KMT2A 2284/4885SMN1; SMN2 4643/4885
US-10961266-B2 Chemoselective methylene hydroxylation in aromatic molecules PAH, DBH, AHR MEN1 1627/4885KMT2A 746/4885SMN1; SMN2 2130/4885
US-20210115045-A1 HETEROBICYCLIC INHIBITORS OF MAT2A AND METHODS OF USE FOR TREATING CANCER MAT2A, MAT2B, MAT1A MEN1 1001/4885KMT2A 189/4885SMN1; SMN2 1469/4885
US-20200087331-A1 CHEMOSELECTIVE METHYLENE HYDROXYLATION IN AROMATIC MOLECULES PAH, DBH, AHR MEN1 1627/4885KMT2A 746/4885SMN1; SMN2 2130/4885
US-20110124884-A1 PROCESS FOR PRODUCING THIOPHENE COMPOUND AND INTERMEDIATE THEREOF TST, SULT1E1, GRHPR MEN1 4668/4885KMT2A 921/4885SMN1; SMN2 4842/4885
US-20110065634-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE GLP1R, GCGR, GIPR MEN1 738/4885KMT2A 3064/4885SMN1; SMN2 4692/4885
US-11524960-B2 Heterobicyclic inhibitors of MAT2A and methods of use for treating cancer MAT2A, MAT2B, MAT1A MEN1 1001/4885KMT2A 189/4885SMN1; SMN2 1469/4885
US-10017508-B2 Nitrogenated heterocyclic compound PDE2A, PDE5A, PDE3A MEN1 1770/4885KMT2A 262/4885SMN1; SMN2 534/4885
US-20120172448-A1 Substituted 1-benzylcycloalkylcarboxylic acids and the use thereof PC, ACACA, PCCA MEN1 3894/4885KMT2A 3289/4885SMN1; SMN2 3197/4885

“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.