SCHEMBL7103588

SCHEMBL7103588

COc1ccc(/C=C/c2ccc(/C=C/c3ccc(OC)cc3C#N)s2)c(C#N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
NCOA3 Q9Y6Q9 1/20 0.46
NQO1 P15559 1/20 0.45
MEN1 O00255 7/20 0.45
KMT2A Q03164 7/20 0.45
MAPT P10636 5/20 0.45
CASP1 P29466 4/20 0.45
CASP7 P55210 4/20 0.45
MAPK1 P28482 4/20 0.45
TDP1 Q9NUW8 3/20 0.45
ALOX15 P16050 2/20 0.45
RUNX1 Q01196 1/20 0.45
CBFB Q13951 1/20 0.45
CYP1A2 P05177 9/20 0.45
CYP1A1 P04798 8/20 0.45

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
SCHEMBL15937804 0.82 NQO1 (0.51) L3MBTL1PPARGNCOA2NCOA1NPSR1
SCHEMBL15937803 0.82 NQO1 (0.51) L3MBTL1PPARGNCOA2NCOA1NPSR1
SCHEMBL7103558 0.81 CYP1A2 (0.63) L3MBTL1PPARGNCOA2NCOA1NPSR1
SCHEMBL7433184 0.76 ALDH1A1 (0.58) L3MBTL1PPARGNCOA2NCOA1NPSR1
SCHEMBL9239065 0.75 CYP1A1 (0.69) CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4
SCHEMBL9239060 0.75 CYP1A1 (0.69) CYP1A2CYP1A1CYP1B1NFE2L2CYP3A4
SCHEMBL1478811 0.75 THRB (0.51) L3MBTL1PPARGNCOA2NCOA1NPSR1
SCHEMBL1478806 0.75 THRB (0.51) L3MBTL1PPARGNCOA2NCOA1NPSR1
SCHEMBL9238385 0.74 NQO2 (0.61) L3MBTL1MEN1KMT2AMAPTCASP1
SCHEMBL9560109 0.70 MAOB (0.57) L3MBTL1PPARGNCOA2NCOA1NPSR1

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
WO-2004000970-A1 COLOR TUNABLE PHOTOLUMINESCENT BLENDS CASE WESTERN RESERVE UNIVERSITY (US) 2003-12-31 WO disclosed