SCHEMBL16656336

SCHEMBL16656336

Cc1ccc(-c2ccc3c(c2)-c2cc(C)ccc2C(=O)C3=C(C#N)C#N)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
USP8 P40818 1/20 0.40
USP7 Q93009 1/20 0.40
ELANE P08246 1/20 0.40
ALKBH3 Q96Q83 4/20 0.39
MAPT P10636 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
APAF1 O14727 1/20 0.38
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
THRB P10828 1/20 0.38
XBP1 P17861 1/20 0.38
PTBP1 P26599 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
GALK1 P51570 1/20 0.38
BLM P54132 1/20 0.38
SMAD3 P84022 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
SCHEMBL16656339 0.91 MAPT (0.42) MAOAMAOBUSP8USP7ELANE
SCHEMBL12113759 0.91 MAOA (0.48) MAOAMAOBUSP8USP7ELANE
SCHEMBL16602029 0.90 PTGS1 (0.38) MAOAMAOBUSP8USP7ELANE
SCHEMBL12590260 0.88 CYP2A6 (0.40) MAOAMAOBUSP8USP7ELANE
SCHEMBL16601980 0.87 ALKBH3 (0.36) MAOAMAOBUSP8USP7ELANE
SCHEMBL16601967 0.84 TDP2 (0.35) MAOAMAOBUSP8USP7ELANE
SCHEMBL16602022 0.84 EGFR (0.43) MAOAMAOBMAPTMEN1KMT2A
SCHEMBL16602010 0.82 MAPT (0.40) MAPTMEN1KMT2AAPAF1NPC1
SCHEMBL12113903 0.82 MAPT (0.49) MAOAMAOBUSP8USP7ELANE
SCHEMBL12187472 0.80 TDP2 (0.45) MAPTMEN1KMT2AAPAF1NPC1

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