SCHEMBL5194597

SCHEMBL5194597

Oc1ccc2ccccc2c1Cc1c(O)ccc2ccccc12.Oc1ccccc1Cc1ccccc1O

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 3/20 0.79
CYP1A2 P05177 3/20 0.79
CYP2C9 P11712 2/20 0.79
CYP2C19 P33261 2/20 0.79
KDM4E B2RXH2 6/20 0.58
MAPT P10636 5/20 0.58
ALDH1A1 P00352 4/20 0.58
GAA P10253 4/20 0.58
TAAR1 Q96RJ0 1/20 0.58
HSPA5 P11021 1/20 0.57
TDP1 Q9NUW8 2/20 0.53
GLA P06280 1/20 0.53
HPGD P15428 1/20 0.53
POLB P06746 1/20 0.48
CRHBP P24387 1/20 0.47
CRHR2 Q13324 1/20 0.47
PTPN22 Q9Y2R2 1/20 0.47
HIF1A Q16665 2/20 0.47
CYP3A4 P08684 1/20 0.47
TSHR P16473 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
SCHEMBL36762 0.89 HSD17B10 (1.00) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL29357214 0.89 HSD17B10 (1.00) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL5134884 0.85 CYP1A2 (0.85) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
1-Naphthol SCHEMBL9575454 0.85 CYP1A2 (0.85) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL1979550 0.84 HSD17B10 (0.76) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL23499944 0.84 CYP1A2 (0.75) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL29625648 0.84 CYP1A2 (0.75) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL19039001 0.82 HSD17B10 (0.72) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL26794966 0.81 HSD17B10 (0.85) HSD17B10CYP1A2CYP2C9CYP2C19KDM4E
SCHEMBL8963436 0.81 HSPA5 (0.67) HSD17B10CYP1A2CYP2C9CYP2C19HSPA5

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-7211374-B2 Thermally developable material package with dual indicator device EASTMAN KODAK COMPANY (US) 2007-05-01 US disclosed