SCHEMBL8976079

SCHEMBL8976079

Cc1cc(-c2ccccc2C)c(O)cc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.58
MAPT P10636 4/20 0.58
ALOX15 P16050 4/20 0.58
ALDH1A1 P00352 3/20 0.58
CYP1A2 P05177 2/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2D6 P10635 2/20 0.58
CYP2C9 P11712 2/20 0.58
CYP2C19 P33261 2/20 0.58
KDM4E B2RXH2 2/20 0.58
NPSR1 Q6W5P4 2/20 0.58
HSD17B10 Q99714 2/20 0.58
G6PD P11413 1/20 0.58
PKM P14618 1/20 0.58
ALOX12 P18054 1/20 0.58
MAPK1 P28482 1/20 0.58
CCR6 P51684 1/20 0.58
HIF1A Q16665 1/20 0.58
MCL1 Q07820 1/20 0.44
RAB9A P51151 4/20 0.43

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
SCHEMBL26431805 0.85 KDM4E (0.78) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL17914304 0.83 KDM4E (0.74) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL26437128 0.80 ALDH1A1 (0.79) HPGDMAPTALOX15ALDH1A1CYP1A2
Hydrochloric Acid SCHEMBL6896794 0.79 CYP3A4 (0.45) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL1163819 0.78 HPGD (0.49) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL31746199 0.78 HPGD (0.59) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL15430420 0.78 HPGD (0.59) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL31545845 0.78 ALDH1A1 (0.75) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL31337248 0.78 HPGD (0.52) HPGDMAPTALOX15ALDH1A1CYP1A2
SCHEMBL758202 0.78 HPGD (0.52) HPGDMAPTALOX15ALDH1A1CYP1A2

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-5501936-A IMPROVED RESOLUTION OF VERY FINE PATTERNS TOKYO OHKA KOGYO CO., LTD. (JP) 1996-03-26 US disclosed