SCHEMBL7258665

SCHEMBL7258665

C=CCOc1cc(N)ccc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 1/20 0.42
ALOX5 P09917 1/20 0.42
AR P10275 1/20 0.42
PTGS1 P23219 1/20 0.42
TRPM8 Q7Z2W7 1/20 0.42
PRKCI P41743 1/20 0.42
TSHR P16473 2/20 0.41
GAA P10253 1/20 0.41
HPGD P15428 2/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 2/20 0.41
PDE10A Q9Y233 1/20 0.41
ACHE P22303 3/20 0.41
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
CA7 P43166 1/20 0.40
LIG1 P18858 1/20 0.39

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
SCHEMBL11813956 0.86 PRKCI (0.40) ALDH1A1CYP3A4ALOX5ARPTGS1
SCHEMBL7112756 0.84 ALDH1A1 (0.52) ALDH1A1TSHRGAAHPGDMAPK1
SCHEMBL6707110 0.82 MAOB (0.50) ALDH1A1CYP3A4ALOX5ARPTGS1
SCHEMBL5665856 0.82 ALDH1A1 (0.41) ALDH1A1CYP3A4TSHRGAAHPGD
SCHEMBL25403106 0.79 HPGD (0.43) ALDH1A1TSHRGAAHPGDMAPK1
SCHEMBL9781407 0.79 SYK (0.50) ALDH1A1CYP3A4TSHRGAAHPGD
SCHEMBL14206692 0.79 ALDH1A1 (0.43) ALDH1A1CYP3A4TSHRGAAHPGD
SCHEMBL31312955 0.79 HPGD (0.43) ALDH1A1TSHRGAAHPGDMAPK1
SCHEMBL17861605 0.79 ALDH1A1 (0.41) ALDH1A1CYP3A4ALOX5ARPTGS1
SCHEMBL5210543 0.79 HPGD (0.58) ALDH1A1CYP3A4ALOX5ARPTGS1

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
US-6635241-B1 Applying aminophenol derivative to keratinous fiber as primary intermediate, oxidizing to color fiber HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2003-10-21 US disclosed
EP-1229891-A1 AGENT FOR COLOURING KERATIN CONTAINING FIBRES Henkel Kommanditgesellschaft auf Aktien (DE) 2002-08-14 EP disclosed
WO-2001034105-A1 AGENT FOR COLOURING KERATIN CONTAINING FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2001-05-17 WO disclosed
EP-0883598-A1 AMINOPHENOL DERIVATIVES AND THEIR USE IN OXIDATIVE HAIR DYES Henkel Kommanditgesellschaft auf Aktien (DE) 1998-12-16 EP disclosed
WO-1997031886-A1 AMINOPHENOL DERIVATIVES AND THEIR USE IN OXIDATIVE HAIR DYES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1997-09-04 WO disclosed