SCHEMBL16656184

SCHEMBL16656184

Cc1ccc(-c2cccc3c2C(=O)c2cccc(C)c2C3=O)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
CA7 P43166 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
CASP3 P42574 1/20 0.43
RAB9A P51151 1/20 0.43
HBB P68871 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
SENP6 Q9GZR1 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA12 O43570 1/20 0.43
DAO P14920 1/20 0.42
MEN1 O00255 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
SCHEMBL5012339 0.87 ELANE (0.52) NPC1ALDH1A1CYP3A4TSHRMAPK1
SCHEMBL14922774 0.84 ELANE (0.47) ADORA3NPC1ALDH1A1CYP3A4TSHR
SCHEMBL1688847 0.84 ALDH1A1 (0.55) CA1CA2CA9CA7NPC1
SCHEMBL3355657 0.82 ENPP1 (0.42) CA1CA2CA9CA7ADORA3
Methane SCHEMBL11860700 0.80 ENPP1 (0.41) CA1CA2CA9CA7ADORA3
SCHEMBL16656182 0.80 PTGS2 (0.42) CA1CA2CA9CA7NPC1
SCHEMBL20618707 0.79 POLB (0.60) ADORA3NPC1ALDH1A1CYP3A4TSHR
SCHEMBL9018851 0.79 ELANE (0.55) NPC1ALDH1A1CYP3A4TSHRMAPK1
SCHEMBL224650 0.78 ALDH1A1 (0.66) NPC1ALDH1A1CYP3A4TSHRMAPK1
SCHEMBL30580334 0.78 ALDH1A1 (0.66) NPC1ALDH1A1CYP3A4TSHRMAPK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed
US-9012112-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-04-21 US disclosed