SCHEMBL16656171

SCHEMBL16656171

CN=C1c2cccc(-c3ccccc3)c2-c2c1cccc2-c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
MAPK1 P28482 1/20 0.43
PDCD1 Q15116 1/20 0.38
CD274 Q9NZQ7 1/20 0.38
HNF4A P41235 1/20 0.38
HSD17B10 Q99714 2/20 0.38
CYP2A6 P11509 2/20 0.38
HPGD P15428 1/20 0.38
BCL2L1 Q07817 1/20 0.38
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
PTGS2 P35354 1/20 0.35
BACE1 P56817 3/20 0.34
DPP4 P27487 1/20 0.34

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
SCHEMBL192418 0.73 ALDH1A1 (0.50) ALDH1A1MAPK1PDCD1CD274HNF4A
SCHEMBL10292917 0.73 KMT2A (0.52) ALDH1A1MAPK1HSD17B10MEN1KMT2A
SCHEMBL6540764 0.72 CASP3 (0.38) ALDH1A1MAPK1PDCD1CD274HNF4A
SCHEMBL12111787 0.72 ALDH1A1 (0.38) ALDH1A1PDCD1CD274CASP3SENP8
SCHEMBL4423042 0.72 ALDH1A1 (0.44) ALDH1A1MAPK1PDCD1CD274HNF4A
Methyl Alcohol SCHEMBL27488232 0.72 ALDH1A1 (0.50) ALDH1A1MAPK1PDCD1CD274HNF4A
SCHEMBL27608314 0.72 ALDH1A1 (0.44) ALDH1A1MAPK1PDCD1CD274HNF4A
SCHEMBL9469764 0.71 ALDH1A1 (0.48) ALDH1A1MAPK1PDCD1CD274HNF4A
Water SCHEMBL432858 0.71 ALDH1A1 (0.48) ALDH1A1MAPK1PDCD1CD274HNF4A
SCHEMBL2806539 0.71 ALDH1A1 (0.48) ALDH1A1MAPK1PDCD1CD274HNF4A

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