SCHEMBL8075313

SCHEMBL8075313

CCc1cccc(Nc2ccc(O)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.54
KIF11 P52732 1/20 0.49
CYP3A4 P08684 2/20 0.48
TSHR P16473 1/20 0.48
MAPT P10636 5/20 0.47
ALDH1A1 P00352 4/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
ALOX15 P16050 3/20 0.47
HPGD P15428 2/20 0.47
MAPK1 P28482 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
GAA P10253 2/20 0.47
APAF1 O14727 1/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47
ALOX12 P18054 1/20 0.47
CASP1 P29466 1/20 0.47
BLM P54132 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL8896899 0.87 RAPGEF4 (0.67) RAPGEF4KIF11TSHRMAPTALDH1A1
SCHEMBL4701514 0.85 RAPGEF4 (0.61) RAPGEF4KIF11CYP3A4TSHRMAPT
SCHEMBL27977809 0.82 ENPP2 (0.55) CYP3A4TSHRMAPTALDH1A1MEN1
SCHEMBL8067239 0.82 RAPGEF4 (0.54) RAPGEF4KIF11CYP3A4MAPTALDH1A1
SCHEMBL6029581 0.82 RAPGEF4 (0.54) RAPGEF4KIF11TSHRMAPTALDH1A1
SCHEMBL6331942 0.82 CYP3A4 (0.63) RAPGEF4CYP3A4TSHRMAPTALDH1A1
SCHEMBL29939003 0.82 RAPGEF4 (0.54) RAPGEF4KIF11TSHRMAPTALDH1A1
SCHEMBL13302359 0.80 CYP3A4 (0.64) RAPGEF4CYP3A4TSHRMAPTALDH1A1
SCHEMBL5543379 0.79 RAPGEF4 (0.54) RAPGEF4KIF11TSHRMAPTALDH1A1
SCHEMBL8897281 0.78 RAPGEF4 (0.67) RAPGEF4KIF11CYP3A4TSHRMAPT

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-1030572-A1 PRODUCT APPLICATOR THE PROCTER & GAMBLE COMPANY (US) 2000-08-30 EP disclosed
WO-1999026508-A1 PRODUCT APPLICATOR THE PROCTER & GAMBLE COMPANY (US) 1999-06-03 WO disclosed
EP-0876134-A4 HAIR COLORING COMPOSITIONS PROCTER & GAMBLE (US) 1999-01-07 EP disclosed
EP-0876134-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-11-11 EP disclosed
WO-1997024107-A1 HAIR COLORING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-07-10 WO disclosed