SCHEMBL9258219

SCHEMBL9258219

C=CCc1c(-c2ccc(O)cc2)cccc1S(N)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.40
AKR1B1 P15121 1/20 0.39
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
CDK2 P24941 1/20 0.37
F10 P00742 8/20 0.36
PRSS1 P07477 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
BRAF P15056 1/20 0.35

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
SCHEMBL9258199 0.78 AKR1B1 (0.45) STAT3AKR1B1GABRA1GABRB2CDK2
SCHEMBL6548544 0.75 F10 (0.52) STAT3CDK2F10CA12CA1
SCHEMBL9253769 0.74 GABRA1 (0.41) AKR1B1GABRA1GABRB2CDK2CA12
SCHEMBL9258217 0.74 HSD17B10 (0.35) GABRA1GABRB2CA12CA1CA2
SCHEMBL6009677 0.74 GABRA1 (0.47) AKR1B1GABRA1GABRB2CA12CA1
SCHEMBL8657376 0.72 ABL1 (0.53) STAT3CDK2F10CA12CA1
SCHEMBL9258213 0.71 LDHA (0.42) STAT3AKR1B1GABRA1GABRB2CA12
SCHEMBL9258201 0.71 CYP2C9 (0.35) GABRA1GABRB2CA12CA1CA2
SCHEMBL29438375 0.70 PDE4A (0.43) STAT3CDK2F10CA12CA1
SCHEMBL4906156 0.69 POLB (0.44) STAT3AKR1B1GABRA1GABRB2CDK2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0479332-B1 Diphenyl-methane derivative, pharmaceutical composition and use EISAI CO LTD (JP) 1995-06-21 EP disclosed
US-5206403-A Diphenylethylene derivatives, pharmaceutical compositions containing same and treatment methods EISAI CO., LTD. (JP) 1993-04-27 US disclosed
US-5182301-A Anticoagulants EISAI CO., LTD. (JP) 1993-01-26 US disclosed
EP-0479332-A2 Diphenyl-methane derivative, pharmaceutical composition and use Eisai Co., Ltd. (JP) 1992-04-08 EP disclosed
US-5103010-A DIPHENYLETHYLENE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND TREATMENT METHOD EISAI CO., LTD. (JP) 1992-04-07 US disclosed
EP-0478001-A1 Benzophenone oxime derivatives, pharmaceutical compositions and use Eisai Co., Ltd. (JP) 1992-04-01 EP disclosed
US-5064848-A Anticoagulants EISAI CO., LTD. (JP) 1991-11-12 US disclosed
US-5034418-A Anticoagulants EISAI CO., LTD. (JP) 1991-07-23 US disclosed
US-4978767-A ANTICOAGULANTS EISAI CO., LTD. (JP) 1990-12-18 US disclosed
US-4886834-A ANTICOAGULANTS EISAI CO., LTD. (JP) 1989-12-12 US disclosed
EP-0238973-A2 Diphenyl-methane derivative, pharmaceutical composition and use Eisai Co., Ltd. (JP) 1987-09-30 EP disclosed