SCHEMBL16601773

SCHEMBL16601773

O=C1c2ccc3c4ccc5c6c(ccc(c7ccc(c2c37)C(=O)N1c1cccc(O)c1)c64)C(=O)N(c1cccc(O)c1)C5=O

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.87
RAB9A P51151 2/20 0.87
KDM4E B2RXH2 4/20 0.71
POLB P06746 3/20 0.71
ESR1 P03372 4/20 0.69
KMT2A Q03164 8/20 0.60
MEN1 O00255 7/20 0.60
ALDH1A1 P00352 5/20 0.60
USP2 O75604 5/20 0.60
L3MBTL1 Q9Y468 3/20 0.60
HTT P42858 2/20 0.60
TNNI3 P19429 1/20 0.60
TNNT2 P45379 1/20 0.60
TNNC1 P63316 1/20 0.60
TLR9 Q9NR96 1/20 0.60
APAF1 O14727 1/20 0.54
MAPT P10636 2/20 0.49
KEAP1 Q14145 4/20 0.48
NFE2L2 Q16236 4/20 0.48
ESR2 Q92731 2/20 0.47

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
SCHEMBL16521526 0.93 NPC1 (1.00) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL18201564 0.89 NPC1 (0.69) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL16601770 0.87 NPC1 (0.66) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL18198714 0.87 NPC1 (0.66) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL17278253 0.85 NPC1 (0.62) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL18470134 0.84 NPC1 (0.82) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL9588495 0.81 ESR1 (1.00) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL1662738 0.81 ESR1 (0.80) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL28563147 0.81 NPC1 (0.70) NPC1RAB9AKDM4EPOLBESR1
SCHEMBL3628513 0.81 KMT2A (0.71) NPC1RAB9AKDM4EPOLBESR1

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-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