SCHEMBL31474285

SCHEMBL31474285

c1ccc2cc3cc4cc5c(Oc6cccc7cc8cc9cc%10ccccc%10cc9cc8cc67)cccc5cc4cc3cc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.45
ALDH1A1 P00352 7/20 0.42
KDM4E B2RXH2 4/20 0.42
GAA P10253 3/20 0.42
HSD17B10 Q99714 5/20 0.41
HIF1A Q16665 2/20 0.41
CYP1B1 Q16678 1/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
RCE1 Q9Y256 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HBB P68871 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP1A2 P05177 4/20 0.38
ERBB2 P04626 1/20 0.38

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
SCHEMBL9616917 1.00 NQO1 (0.45) NQO1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL1783813 0.98 NQO1 (0.46) NQO1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL2555609 0.96 ALDH1A1 (0.48) NQO1ALDH1A1KDM4EGAAHSD17B10
Lithium SCHEMBL6571294 0.95 NQO1 (0.45) NQO1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL443617 0.91 ALDH1A1 (0.48) NQO1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL29385434 0.91 ALDH1A1 (0.48) NQO1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL258664 0.91 ALDH1A1 (0.48) NQO1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL1441005 0.90 CTNNB1 (0.43) NQO1ALDH1A1KDM4EGAAMEN1
SCHEMBL3464859 0.89 GAA (0.46) NQO1ALDH1A1KDM4EGAAHSD17B10
SCHEMBL28450691 0.89 CYP1A2 (0.44) NQO1ALDH1A1HSD17B10MEN1KMT2A

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
CN-116390975-B Grease composition and electronic component using same 京瓷株式会社 2025-04-22 CN disclosed