SCHEMBL16601827

SCHEMBL16601827

Nc1ccc(-c2ccc3c(c2)C(=O)c2ccccc2C3=O)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.70
RAB9A P51151 5/20 0.70
SMN1; SMN2 Q16637 4/20 0.70
ALDH1A1 P00352 4/20 0.70
CYP3A4 P08684 2/20 0.70
TDP1 Q9NUW8 2/20 0.70
MAPK1 P28482 2/20 0.70
TP53 P04637 1/20 0.70
TSHR P16473 1/20 0.70
PTPRC P08575 6/20 0.62
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
LMNA P02545 3/20 0.62
APAF1 O14727 2/20 0.62
PTBP1 P26599 2/20 0.62
HTT P42858 2/20 0.62
GALK1 P51570 2/20 0.62
BLM P54132 2/20 0.62
SMAD3 P84022 2/20 0.62
NPSR1 Q6W5P4 2/20 0.62

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
SCHEMBL31255810 0.90 NPC1 (0.54) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL31255811 0.90 NPC1 (0.54) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL28863139 0.87 NPC1 (0.68) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL17715429 0.87 NPC1 (0.54) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL57813 0.85 NPC1 (0.80) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL30722379 0.85 NPC1 (0.80) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL21993324 0.85 NPC1 (0.80) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL1482692 0.83 MEN1 (0.84) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL7322266 0.83 MEN1 (0.84) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4
Anthraquinone SCHEMBL23363689 0.83 NPC1 (1.00) NPC1RAB9ASMN1; SMN2ALDH1A1CYP3A4

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 4 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
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed