SCHEMBL8648154

SCHEMBL8648154

O=S(=O)(Nc1cc2cccccc-2c1-c1ccc(F)c(Cl)c1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.51
PTGS1 P23219 1/20 0.51
ACLY P53396 14/20 0.51
PIK3CD O00329 1/20 0.47
PIK3CA P42336 1/20 0.47
PIK3CB P42338 1/20 0.47
PIK3CG P48736 1/20 0.47
STAT3 P40763 1/20 0.46

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
SCHEMBL8663418 0.87 STAT3 (0.59) PTGS2PTGS1STAT3
SCHEMBL8650268 0.85 MCL1 (0.51) ACLYPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL8645738 0.85 NAT1 (0.60) ACLYPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL8657396 0.84 PTGS2 (0.52) PTGS2PTGS1ACLYSTAT3
SCHEMBL8646611 0.82 ACLY (0.60) PTGS2PTGS1ACLY
SCHEMBL8646709 0.82 PTGES2 (0.48) ACLYPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL8660105 0.78 PTGS2 (0.47) PTGS2PTGS1ACLY
SCHEMBL8645956 0.77 MCL1 (0.62) ACLYPIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL8658333 0.77 STAT3 (0.59) ACLYSTAT3
SCHEMBL8659417 0.77 HPGD (0.48) PTGS2PTGS1ACLYSTAT3

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-5843999-A 2-phenylazulene derivatives and a manufacturing method of these compounds KOTOBUKI SEIYAKU CO., LTD. (JP) 1998-12-01 US disclosed