SCHEMBL16656187

SCHEMBL16656187

CCCc1ccc2c(c1)C(=O)c1cc(C)ccc1C2=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.58
MAOA P21397 2/20 0.55
MAOB P27338 1/20 0.55
NPC1 O15118 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
MAPK1 P28482 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
LCK P06239 1/20 0.45
NQO1 P15559 3/20 0.42
POR P16435 3/20 0.42
CA2 P00918 4/20 0.40
CA1 P00915 3/20 0.40
CA9 Q16790 3/20 0.40
CA4 P22748 2/20 0.40

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
SCHEMBL11539069 0.91 NPC1 (0.62) ELANEMAOAMAOBNPC1ALDH1A1
SCHEMBL7044117 0.88 ELANE (0.53) ELANEMAOAMAOBNPC1ALDH1A1
SCHEMBL7049744 0.88 ELANE (0.53) ELANEMAOAMAOBNPC1ALDH1A1
SCHEMBL30811431 0.85 NPC1 (0.72) ELANEMAOAMAOBNPC1ALDH1A1
SCHEMBL13168836 0.85 NPC1 (0.72) ELANEMAOAMAOBNPC1ALDH1A1
SCHEMBL2107773 0.85 NPC1 (0.72) ELANEMAOANPC1ALDH1A1LMNA
SCHEMBL13168834 0.85 NPC1 (0.72) ELANEMAOAMAOBNPC1ALDH1A1
SCHEMBL26190669 0.84 NPC1 (0.70) ELANENPC1ALDH1A1LMNAMAPT
SCHEMBL13168819 0.82 MAPT (0.68) ELANEMAOAMAOBNPC1ALDH1A1
SCHEMBL13168820 0.81 MAPT (0.67) ELANEMAOAMAOBNPC1ALDH1A1

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