SCHEMBL9214656

SCHEMBL9214656

CS(=O)(=O)Nc1cc(C(=O)CNCCc2ccccc2)c(F)cc1F

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 1/20 0.47
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
FABP4 P15090 1/20 0.41
MCL1 Q07820 1/20 0.41
BCL2A1 Q16548 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SIRT5 Q9NXA8 1/20 0.40

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
SCHEMBL9218206 0.80 NR3C1 (0.44)
SCHEMBL9214645 0.79 NR3C1 (0.45) RAB9AKDM4EALDH1A1
SCHEMBL13869116 0.76 BRD4 (0.39) FABP4
SCHEMBL3527949 0.74 FABP4 (0.52) FABP4MCL1KDM4EALDH1A1
SCHEMBL6564672 0.71 EPHX1 (0.57)
SCHEMBL3525455 0.69 KDM4E (0.55) FABP4KDM4EALDH1A1
SCHEMBL2291802 0.68 NPC1 (0.63) NPC1RAB9ATAAR1KDM4EALDH1A1
SCHEMBL13719793 0.68 TRPV1 (0.41) FABP4
SCHEMBL2290484 0.68 GPR52 (0.52) NPC1RAB9ATAAR1KDM4EALDH1A1
SCHEMBL4625378 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0538469-B1 SULFONANILIDE DERIVATIVE AND MEDICINE NIPPON SHINYAKU CO LTD (JP) 1995-09-27 EP disclosed
US-5360822-A FOR TREATING URINARY INCONTINENCE IN ANIMALS AND HUMANS NIPPON SHINYAKU CO. LTD. (JP) 1994-11-01 US disclosed
EP-0538469-A1 SULFONANILIDE DERIVATIVE AND MEDICINE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-04-28 EP disclosed