SCHEMBL14063397

SCHEMBL14063397

CC(=O)OCc1ccc(N(c2ccc(COC(C)=O)cc2)c2ccc(-c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
MAOB P27338 2/20 0.42
MMP12 P39900 3/20 0.41
CYP3A4 P08684 1/20 0.41
MMP2 P08253 2/20 0.40
MMP1 P03956 1/20 0.40
MMP9 P14780 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 2/20 0.39
HPGD P15428 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HSD17B10 Q99714 1/20 0.39
P2RX4 Q99571 1/20 0.39
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 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
SCHEMBL14063394 0.95 ALDH1A1 (0.55) ALDH1A1MAOBMMP12CYP3A4MMP2
SCHEMBL14063414 0.94 ALDH1A1 (0.56) ALDH1A1CYP3A4NPC1RAB9AKDM4E
SCHEMBL9686517 0.90 ALDH1A1 (0.60) ALDH1A1MAOBMMP12CYP3A4MMP2
SCHEMBL9687590 0.90 ALDH1A1 (0.60) ALDH1A1MAOBMMP12CYP3A4MMP2
SCHEMBL14063417 0.89 ALDH1A1 (0.51) ALDH1A1CYP3A4NPC1RAB9AKDM4E
SCHEMBL14063413 0.89 ALDH1A1 (0.51) ALDH1A1CYP3A4NPC1RAB9AKDM4E
SCHEMBL14063390 0.88 ALDH1A1 (0.62) ALDH1A1CYP3A4NPC1KDM4EHPGD
SCHEMBL9581057 0.88 ALDH1A1 (0.64) ALDH1A1MMP12NPC1RAB9AHPGD
SCHEMBL14063398 0.88 ALDH1A1 (0.64) ALDH1A1MMP12NPC1RAB9AHPGD
SCHEMBL14063393 0.88 ALDH1A1 (0.64) ALDH1A1MMP12NPC1RAB9AHPGD

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-8426093-B2 photosensitive layer has a charge transferring compound having hole transportation ability; hardening by heating, stable electrical properties FUJI XEROX CO., LTD. (JP) 2013-04-23 US disclosed
US-8426093-B2 photosensitive layer has a charge transferring compound having hole transportation ability; hardening by heating, stable electrical properties FUJI XEROX CO., LTD. (JP) 2013-04-23 US disclosed
US-20080220356-A1 Electrophotographic photoreceptor, process cartridge and image-forming apparatus FUJI XEROX CO., LTD. (JP) 2008-09-11 US disclosed
US-20080220356-A1 Electrophotographic photoreceptor, process cartridge and image-forming apparatus FUJI XEROX CO., LTD. (JP) 2008-09-11 US disclosed