SCHEMBL8985463

SCHEMBL8985463

CSc1ccc(-c2cc(Cl)sc2-c2ccc(N(C)C=O)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.32
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
NOX1 Q9Y5S8 1/20 0.30
UBE2N P61088 1/20 0.30
NPC1 O15118 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL8985493 0.85 PTGS1 (0.41) PTGS1PTGS2ALDH1A1L3MBTL1NOX1
SCHEMBL8985338 0.82 MAPK14 (0.46) PTGS1PTGS2L3MBTL1NOX1UBE2N
SCHEMBL8985322 0.82 PTGS2 (0.33) PTGS1PTGS2
SCHEMBL8985449 0.81 OPRD1 (0.38) PTGS1PTGS2L3MBTL1NOX1UBE2N
SCHEMBL8985529 0.81
SCHEMBL8985365 0.79 PTGS1 (0.35) PTGS1PTGS2ALDH1A1L3MBTL1UBE2N
SCHEMBL8985294 0.77 PTGS1 (0.40) PTGS1PTGS2ALDH1A1L3MBTL1UBE2N
SCHEMBL8985530 0.77 MAPK14 (0.52) PTGS1PTGS2ALDH1A1L3MBTL1UBE2N
SCHEMBL8585909 0.76 ALDH1A1 (0.50) ALDH1A1NOX1
SCHEMBL8985459 0.76 CYP1A2 (0.37) PTGS1PTGS2ALDH1A1L3MBTL1UBE2N

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5571810-A ANTIINFLAMMATORY AGENTS, ANALGESICS, COLLAGEN DISEASES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-11-05 US disclosed