SCHEMBL9258217

SCHEMBL9258217

C=CCc1c(S(N)(=O)=O)ccc(C(=O)O)c1-c1ccc(O)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 2/20 0.35
CYP2C9 P11712 2/20 0.35
MCL1 Q07820 1/20 0.35
CA2 P00918 8/20 0.33
CA1 P00915 7/20 0.33
CA9 Q16790 7/20 0.33
CA12 O43570 5/20 0.33
CA7 P43166 4/20 0.33
CA14 Q9ULX7 4/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
CA3 P07451 3/20 0.33
CA4 P22748 3/20 0.33
CA6 P23280 3/20 0.33
CA13 Q8N1Q1 3/20 0.33
CA5B Q9Y2D0 3/20 0.33
CA5A P35218 2/20 0.33
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 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
SCHEMBL9258201 0.90 CYP2C9 (0.35) HSD17B10CYP2C9MCL1CA2CA1
SCHEMBL9258213 0.79 LDHA (0.42) HSD17B10CYP2C9MCL1CA2CA1
SCHEMBL9258219 0.74 STAT3 (0.40) CA2CA1CA9CA12GABRA1
SCHEMBL6255456 0.72 RXRA (0.42) HSD17B10MCL1ALDH1A1TSHRKDM4E
SCHEMBL9258199 0.71 AKR1B1 (0.45) CA2CA1CA9CA12GABRA1
SCHEMBL901173 0.69 HSD17B10 (0.55) HSD17B10CA2CA1CA9CA12
SCHEMBL996835 0.67 CYP1A2 (0.44) HSD17B10CA2CA1CA9CA12
SCHEMBL10693944 0.67 SRD5A1 (0.45) HSD17B10CYP2C9CA2CA1CA9
SCHEMBL30112817 0.66 GABRA1 (0.51) ALDH1A1KDM4ESRD5A1GABRA1GABRB2
SCHEMBL5329793 0.66 KDM4E (0.35) HSD17B10CYP2C9MCL1ALDH1A1TSHR

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 12 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-4954523-A ANTICOAGULANT EISAI CO., LTD. (JP) 1990-09-04 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