SCHEMBL9845792

SCHEMBL9845792

Cc1c2ccccc2c2c3cccc4c(O)ccc(c5cccc1c52)c43

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.54
TSHR P16473 2/20 0.54
CASP1 P29466 2/20 0.54
HSD17B10 Q99714 2/20 0.54
APP P05067 1/20 0.54
MAPT P10636 1/20 0.54
THRB P10828 1/20 0.54
ALOX15 P16050 1/20 0.54
SNCA P37840 1/20 0.54
RECQL P46063 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
ATM Q13315 2/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
CASP7 P55210 1/20 0.46
HIF1A Q16665 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
IDO1 P14902 6/20 0.44
ESR2 Q92731 5/20 0.41

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
SCHEMBL15892260 0.81 RECQL (0.70) HPGDTSHRCASP1HSD17B10APP
SCHEMBL10884065 0.81 RECQL (0.70) HPGDTSHRCASP1HSD17B10APP
SCHEMBL5274050 0.75 HSD17B10 (0.57) HPGDTSHRCASP1HSD17B10THRB
SCHEMBL29276382 0.75 HPGD (0.56) HPGDTSHRCASP1HSD17B10APP
SCHEMBL29037340 0.74 CYP1A2 (0.56) HPGDTSHRCASP1HSD17B10APP
SCHEMBL4188624 0.73 IDO1 (0.55) HPGDTSHRCASP1HSD17B10APP
SCHEMBL8996218 0.73 HSD17B10 (0.58) HPGDTSHRCASP1HSD17B10APP
SCHEMBL30849902 0.72 CYP1A2 (0.67) HPGDTSHRCASP1HSD17B10APP
SCHEMBL598697 0.72 HSD17B10 (0.64) HPGDTSHRCASP1HSD17B10MAPT
SCHEMBL2407577 0.71 HPGD (1.00) HPGDTSHRCASP1HSD17B10APP

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
EP-0413114-A2 Method for bonding an analyte-sensitive dye compound to an addition-cure silicone PURITAN-BENNETT CORPORATION (US) 1991-02-20 EP claimed