SCHEMBL14063394

SCHEMBL14063394

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

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
MAOB P27338 2/20 0.45
CYP3A4 P08684 1/20 0.44
MMP2 P08253 2/20 0.43
MMP12 P39900 2/20 0.43
MMP1 P03956 1/20 0.43
MMP9 P14780 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HSD17B10 Q99714 1/20 0.42
P2RX4 Q99571 1/20 0.41
AGXT P21549 2/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL14063397 0.95 ALDH1A1 (0.50) ALDH1A1MAOBCYP3A4MMP2MMP12
SCHEMBL14063390 0.93 ALDH1A1 (0.62) ALDH1A1CYP3A4NPC1KDM4EHPGD
SCHEMBL873414 0.89 ALDH1A1 (0.67) ALDH1A1MAOBCYP3A4MMP2MMP12
P-Xylene SCHEMBL9685877 0.89 ALDH1A1 (0.67) ALDH1A1MAOBCYP3A4MMP2MMP12
SCHEMBL14063414 0.88 ALDH1A1 (0.56) ALDH1A1CYP3A4NPC1RAB9AKDM4E
SCHEMBL14063388 0.86 ALDH1A1 (0.70) ALDH1A1CYP3A4NPC1KDM4EHPGD
SCHEMBL159711 0.86 ALDH1A1 (0.70) ALDH1A1CYP3A4NPC1KDM4EHPGD
SCHEMBL14063403 0.85 PTGS2 (0.44) ALDH1A1MAOBNPC1RAB9AKDM4E
SCHEMBL14063407 0.85 NPC1 (0.42) ALDH1A1NPC1RAB9AKDM4EHPGD
SCHEMBL22356743 0.85 ALDH1A1 (0.45) ALDH1A1MAOBMMP2MMP12MMP1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8475982-B2 Charge-transporting compound, electrophotographic photoreceptor, image-forming apparatus, and process cartridge FUJI XEROX CO., LTD. (JP) 2013-07-02 US disclosed
US-8475982-B2 Charge-transporting compound, electrophotographic photoreceptor, image-forming apparatus, and process cartridge FUJI XEROX CO., LTD. (JP) 2013-07-02 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-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