SCHEMBL8533974

SCHEMBL8533974

COc1cc(C)nc(NC(=O)Oc2ccccc2)n1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TSHR P16473 2/20 0.53
MAPT P10636 5/20 0.51
KMT2A Q03164 3/20 0.51
ALDH1A1 P00352 4/20 0.48
GAA P10253 1/20 0.48
CYP1A2 P05177 2/20 0.48
TP53 P04637 1/20 0.47
GLA P06280 1/20 0.47
MEN1 O00255 2/20 0.47
KDM4E B2RXH2 1/20 0.47
RECQL P46063 1/20 0.47
POLB P06746 1/20 0.46
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL1576702 0.92 MAPT (0.59) HTTSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL3607553 0.89 RAB9A (0.55) HTTSMN1; SMN2TSHRMAPTKMT2A
SCHEMBL9661273 0.88 POLB (0.53) HTTSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL27501805 0.87 MAPT (0.48) HTTSMN1; SMN2TSHRMAPTKMT2A
SCHEMBL10386794 0.87 HTT (0.51) HTTSMN1; SMN2TSHRMAPTKMT2A
SCHEMBL10747680 0.85 KMT2A (0.43) HTTSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL30925086 0.84 MAPT (0.49) HTTSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL27424384 0.83 KMT2A (0.53) HTTSMN1; SMN2MAPTKMT2AALDH1A1
SCHEMBL9368434 0.82 CYP1A2 (0.59) HTTSMN1; SMN2TSHRMAPTKMT2A
SCHEMBL8447590 0.82 KDM4E (0.48) HTTSMN1; SMN2MAPTKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110642791-A Sulfonylurea compound, preparation method thereof and application thereof in preparing herbicide 南开大学 2020-01-03 CN claimed
EP-0394194-B1 PROTECTED AMINO-ACIDS AND PROCESS FOR THEIR PREPARATION CALBIOCHEM-NOVABIOCHEM AG (CH) 1993-08-18 EP claimed
JP-1038089-A None JP disclosed
CN-114456120-B Bissulfonylamino substituted sulfonylurea compound, and preparation method and application thereof 郑州手性药物研究院有限公司 2024-06-18 CN disclosed
CN-117903066-A Benzene ring alkoxy substituted sulfonylurea compound and application thereof in preparation of selective herbicide 南开大学 2024-04-19 CN disclosed
CN-110642791-B Sulfonylurea compound, preparation method thereof and application thereof in preparing herbicide 南开大学 2022-06-28 CN disclosed
CN-110642791-A Sulfonylurea compound, preparation method thereof and application thereof in preparing herbicide 南开大学 2020-01-03 CN disclosed
EP-0467251-B1 Process for the preparation of N-alkylsulfonylaminosulfonyl ureas HOECHST SCHERING AGREVO GMBH (DE) 1998-06-03 EP disclosed
EP-0238070-B1 Sulfonylurea compounds, their production and herbicidal use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1993-12-29 EP disclosed
US-5155222-A PROCESS FOR THE PREPARATION OF N-ALKYLSULFONYLAMINOSULFONYLUREAS HOECHST AKTIENGESELLSCHAFT (DE) 1992-10-13 US disclosed
EP-0234352-B1 SULFONAMIDE COMPOUNDS AND SALTS THEREOF, HERBICIDAL COMPOSITIONS CONTAINING THEM, AND PROCESS FOR PRODUCING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 1992-04-29 EP disclosed
US-4743290-A Thiophenesulfonamide herbicides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-05-10 US disclosed
EP-0238070-A2 Sulfonylurea compounds, their production and herbicidal use Takeda Chemical Industries, Ltd. (JP) 1987-09-23 EP disclosed
EP-0234352-A1 Sulfonamide compounds and salts thereof, herbicidal compositions containing them, and process for producing them ISHIHARA SANGYO KAISHA, LTD. (JP) 1987-09-02 EP disclosed
US-4677217-A CHEMICAL INTERMEDIATES FOR HERBICIDES CIBA-GEIGY CORPORATION (US) 1987-06-30 US disclosed
EP-0212779-A2 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-03-04 EP disclosed
EP-0207609-A1 Herbicidal thiophenesulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-01-07 EP disclosed
US-4602936-A Herbicidal sulfonylureas CIBA-GEIGY CORPORATION (US) 1986-07-29 US disclosed
US-4559078-A POSTEMERGENCE AND PREEMERGENCE HERBICIDES CIBA-GEIGY CORPORATION (US) 1985-12-17 US disclosed
EP-0164017-A2 Substituted phenyl sulfonyl ureas BAYER AG (DE) 1985-12-11 EP disclosed