SCHEMBL5315001

SCHEMBL5315001

COC(=O)C(CC(=O)c1ccc(S(C)(=O)=O)cc1)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.46
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.40
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
PTGS2 P35354 2/20 0.39
EPHX2 P34913 1/20 0.37
NR1H4 Q96RI1 1/20 0.37

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
SCHEMBL8535189 0.80 KMT2A (0.68) KMT2AL3MBTL1
SCHEMBL5313367 0.78 HAO1 (0.46) KMT2AL3MBTL1MMP2MMP9MMP8
SCHEMBL5314092 0.78 GSR (0.43) GSRKMT2AL3MBTL1MMP2MMP9
SCHEMBL5309685 0.77 GSR (0.51) GSRL3MBTL1MMP2MMP9MMP8
SCHEMBL18770314 0.77 GSR (0.39) GSRKMT2APTGS2EPHX2NR1H4
SCHEMBL27481214 0.76 KMT2A (0.43) KMT2AL3MBTL1
SCHEMBL14518760 0.75 GSR (0.56) GSRMMP2MMP9MMP8
SCHEMBL17290620 0.74 PTGS2 (0.43) GSRKMT2APTGS2
SCHEMBL19659999 0.73 L3MBTL1 (0.60) KMT2AL3MBTL1
SCHEMBL10541229 0.73 GSR (0.54) GSRKMT2AMMP2MMP9MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0799823-B1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses DAIICHI SANKYO CO LTD (JP) 2007-10-31 EP disclosed
US-RE39420-E1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY, LIMITED (JP) 2006-12-05 US disclosed
US-5908858-A OSTEOPOROSIS; LEUKOTRIENE INHIBITOR SANKYO COMPANY, LIMITED (JP) 1999-06-01 US disclosed
EP-0799823-A1 1,2-Diphenylpyrrole derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1997-10-08 EP disclosed