SCHEMBL2701609

SCHEMBL2701609

C=CCS(=O)(=O)NC(N)=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
FGFR4 P22455 1/20 0.32

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
SCHEMBL9001106 0.84 MAPT (0.30) MAPTCACNA1BAPBA1
SCHEMBL28836695 0.80
SCHEMBL6438119 0.79 NPSR1 (0.32)
SCHEMBL7737385 0.79
SCHEMBL8521945 0.78 ALDH1A1 (0.31) MAPTALDH1A1TSHR
SCHEMBL8694565 0.77 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL2155070 0.77 TSHR (0.41) ALDH1A1TSHR
SCHEMBL9766294 0.76 MEN1 (0.32) MEN1KMT2A
SCHEMBL250246 0.76 TSHR (0.30) MAPTTSHR
SCHEMBL250244 0.76 TSHR (0.30) MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1724278-B1 NITROGENOUS FUSED-RING DERIVATIVES, MEDICINAL COMPOSITIONS CONTAINING THE DERIVATIVES, AND USE THEREOF AS DRUGS KISSEI PHARMACEUTICAL (JP) 2014-05-07 EP claimed
EP-1609798-B1 FUSED HETEROCYCLIC DERIVATIVE, MEDICINAL COMPOSITION CONTAINING THE SAME, AND MEDICINAL USE THEREOF KISSEI PHARMACEUTICAL (JP) 2012-05-09 EP claimed
JP-9066673-A None JP disclosed
US-20050176797-A1 2-[5-(5-Carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-YL]-succinic acid derivatives as factor viia inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-08-11 US disclosed
EP-1408963-A1 2- 5-(5-CARBAMIMIDOYL-1 i H /i -HETEROARYL)-6-HYDROXYBIPHENYL-3-YL]-SUCCINIC ACID DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2004-04-21 EP disclosed
US-20030114457-A1 2- [5- (5-carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-yl]-succinic acid derivatives as factor viia inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-06-19 US disclosed
WO-2003006011-A1 2-[5-(5-CARBAMIMIDOYL-1H-HETEROARYL)-6-HYDROXYBIPHENYL-3-YL]-SUCCINIC ACID DERIVATIVES AS FACTOR VIIA INHIBITORS AXYS PHARMACEUTICALS, INC. (US) 2003-01-23 WO disclosed
US-6281240-B1 CYSTIC FIBROSIS ELI LILLY AND COMPANY 2001-08-28 US disclosed
EP-0972797-A1 RUBBER COMPOSITION CONTAINING METAL SALT OF ETHYLENICALLY UNSATURATED CARBOXYLIC ACID NIPPON ZEON CO., LTD. (JP) 2000-01-19 EP disclosed
WO-1998044799-A1 DIARYLSULFONYLUREAS FOR USE IN TREATING SECRETORY DIARRHEA ELI LILLY AND COMPANY (US) 1998-10-15 WO disclosed
US-5668176-A ENDOTHELIN ANTAGONIST MERCK & CO. INC. (US) 1997-09-16 US disclosed
US-5030270-A Sulfonylureas with heterocyclic substituents, and the use thereof as herbicides or plant-growth regulators HOECHST AKTIENGESELLSCHAFT (DE) 1991-07-09 US disclosed
US-4906288-A Herbicidal pyridyl sulfonamides E. I. DU PONT DE NEMOURS AND COMPANY (US) 1990-03-06 US disclosed
EP-0117014-B1 HERBICIDAL N-HYDROXY-N'-SULFONYLGUANIDINES AND SULFONAMIDE INNER SALTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1988-07-06 EP disclosed
US-4723991-A Lower alkyl 2-[[N-(3-cyano-pyridin-2-yl)aminocarbonyl]aminosulphonyl]benzoate derivatives having herbicidal activity E. I. DU PONT DE NEMOURS AND COMPANY (US) 1988-02-09 US disclosed
EP-0125864-B1 HERBICIDAL SULFONAMIDES E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-04-08 EP disclosed
US-4604133-A Herbicidal sulfonamide inner salts E. I. DU PONT DE NEMOURS AND COMPANY (US) 1986-08-05 US disclosed
US-4484939-A PRE-AND POST-EMERGENCE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1984-11-27 US disclosed
EP-0125864-A1 Herbicidal sulfonamides E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-11-21 EP disclosed
EP-0117014-A1 Herbicidal N-hydroxy-N'-sulfonylguanidines and sulfonamide inner salts E.I. DU PONT DE NEMOURS AND COMPANY (US) 1984-08-29 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 (2 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-20030114457-A1 2- [5- (5-carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-yl]-succinic acid derivatives as factor viia inhibitors F7, F9, F5 MAPT 4637/4885CACNA1B 1589/4885APBA1 1476/4885
US-20050176797-A1 2-[5-(5-Carbamimidoyl-1H-heteroaryl)-6-hydroxybiphenyl-3-YL]-succinic acid derivatives as factor viia inhibitors F7, F9, F5 MAPT 4637/4885CACNA1B 1589/4885APBA1 1476/4885

“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.