SCHEMBL28628895

SCHEMBL28628895

Oc1ccc(-c2ccccc2)cc1-c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.46
PNMT P11086 1/20 0.45
HSD17B1 P14061 1/20 0.44
HSD17B2 P37059 1/20 0.44
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 2/20 0.42
MAPT P10636 2/20 0.42
HTT P42858 2/20 0.42
KMT2A Q03164 2/20 0.42
KDM4E B2RXH2 1/20 0.42
USP2 O75604 1/20 0.42
HSP90AA1 P07900 1/20 0.42
GAA P10253 1/20 0.42
ALOX15 P16050 1/20 0.42
ALOX12 P18054 1/20 0.42
ESR2 Q92731 1/20 0.42
ACMSD Q8TDX5 2/20 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
SCHEMBL3366835 0.89 HSD17B1 (0.47) ALOX5PNMTHSD17B1HSD17B2ALDH1A1
SCHEMBL20590538 0.82 PNMT (0.49) PNMTALDH1A1HPGDLMNAMAPT
SCHEMBL28928665 0.81 PNMT (0.50) PNMTNPC1RAB9AKDRADORA2A
SCHEMBL21295458 0.81 APP (0.58) ALOX5PNMTNPC1RAB9ACHEK1
SCHEMBL4631140 0.80 BACE1 (0.41) ALOX5PNMTHSD17B1HSD17B2ALDH1A1
SCHEMBL382855 0.79 PNMT (0.56) ALOX5PNMTALDH1A1HPGDHSD17B10
SCHEMBL27634424 0.79 PNMT (0.46) PNMTALDH1A1HPGDHSD17B10MEN1
SCHEMBL27819054 0.79 PNMT (0.46) PNMTALDH1A1HPGDHSD17B10NPC1
SCHEMBL29126251 0.79 AR (0.44) PNMTHSD17B1HSD17B2NPC1RAB9A
SCHEMBL24434313 0.79 ALOX5 (0.70) ALOX5HSD17B1HSD17B2ALDH1A1HPGD

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-108780166-B Composition for high-refractive-index low-dispersion resin for composite diffractive optical element, and composite diffractive optical element using same 三菱瓦斯化学株式会社 2021-09-28 CN disclosed