SCHEMBL8394302

SCHEMBL8394302

CS(=O)(=O)c1ccc(C(=C2CCCC2)c2ccc(Cl)nc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
BLM P54132 1/20 0.42
EGFR P00533 2/20 0.42
NAPRT Q6XQN6 1/20 0.41
POLB P06746 1/20 0.40
PTGS2 P35354 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAPT P10636 2/20 0.38
ESR1 P03372 1/20 0.38
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
AR P10275 1/20 0.38
CHRM1 P11229 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
PTGS1 P23219 1/20 0.37
RAB9A P51151 1/20 0.36
KDM4E B2RXH2 1/20 0.36
DGAT1 O75907 1/20 0.36

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
SCHEMBL8392541 0.82 ESR1 (0.36) PTGS2ESR1PGRCHRM2ADORA3
SCHEMBL8103928 0.78 PTGS2 (0.54) PTGS2CHRM2CHRM1
SCHEMBL7807203 0.78 ALDH1A1 (0.39) ALDH1A1BLMEGFRNAPRTPOLB
SCHEMBL7811162 0.78 ALDH1A1 (0.39) ALDH1A1BLMEGFRNAPRTPOLB
SCHEMBL7807201 0.78 ALDH1A1 (0.39) ALDH1A1BLMEGFRNAPRTPOLB
SCHEMBL8397422 0.77 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL7808800 0.77 NAPRT (0.51) ALDH1A1BLMEGFRNAPRTSMN1; SMN2
SCHEMBL8104528 0.75 PTGS2 (0.54) PTGS2CHRM2CHRM1
SCHEMBL5698447 0.74 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL29977958 0.72 SMN1; SMN2 (0.59) ALDH1A1BLMEGFRPOLBSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0915850-A1 NOVEL CARBOCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS FOR PREPARING SAME, AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1999-05-19 EP claimed
WO-1998005643-A1 NOVEL CARBOCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS FOR PREPARING SAME, AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1998-02-12 WO claimed
EP-0915850-A1 NOVEL CARBOCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS FOR PREPARING SAME, AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1999-05-19 EP disclosed
WO-1998005643-A1 NOVEL CARBOCYCLIC DIARYLMETHYLENE DERIVATIVES, METHODS FOR PREPARING SAME, AND THERAPEUTICAL USES THEREOF LABORATOIRES UPSA (FR) 1998-02-12 WO disclosed
US-5686460-A ANTIINFLAMMATORY AGENTS, ANALGESICS LABORATOIRES UPSA (FR) 1997-11-11 US disclosed