SCHEMBL14063390

SCHEMBL14063390

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

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.62
CYP3A4 P08684 1/20 0.49
HPGD P15428 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HSD17B10 Q99714 2/20 0.46
MAPK1 P28482 2/20 0.46
NPC1 O15118 1/20 0.46
GAA P10253 1/20 0.46
TSHR P16473 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 2/20 0.45
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
CA2 P00918 2/20 0.40
LMNA P02545 1/20 0.39
IDH1 O75874 1/20 0.38
POLB P06746 1/20 0.38
CA1 P00915 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SLC6A2 P23975 1/20 0.37

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
SCHEMBL14063414 0.94 ALDH1A1 (0.56) ALDH1A1CYP3A4HPGDKDM4EHSD17B10
SCHEMBL159711 0.93 ALDH1A1 (0.70) ALDH1A1CYP3A4HPGDKDM4EHSD17B10
SCHEMBL14063388 0.93 ALDH1A1 (0.70) ALDH1A1CYP3A4HPGDKDM4EHSD17B10
SCHEMBL14063394 0.93 ALDH1A1 (0.55) ALDH1A1CYP3A4HPGDKDM4EHSD17B10
SCHEMBL14063413 0.90 ALDH1A1 (0.51) ALDH1A1CYP3A4HPGDKDM4EHSD17B10
SCHEMBL14063417 0.90 ALDH1A1 (0.51) ALDH1A1CYP3A4HPGDKDM4EHSD17B10
SCHEMBL9581057 0.88 ALDH1A1 (0.64) ALDH1A1HPGDNPC1GAATSHR
SCHEMBL14063398 0.88 ALDH1A1 (0.64) ALDH1A1HPGDNPC1GAATSHR
SCHEMBL14063397 0.88 ALDH1A1 (0.50) ALDH1A1CYP3A4HPGDKDM4EHSD17B10
SCHEMBL14063393 0.88 ALDH1A1 (0.64) ALDH1A1HPGDNPC1GAATSHR

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