SCHEMBL15080652

SCHEMBL15080652

CCOC(=O)OCc1ccc(N(c2ccc(C)cc2)c2ccc(COC(=O)OC)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
NPC1 O15118 3/20 0.43
GAA P10253 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 3/20 0.43
POLB P06746 1/20 0.43
KMT2A Q03164 1/20 0.41
HTT P42858 1/20 0.40
NAAA Q02083 1/20 0.39
MMP2 P08253 2/20 0.39
MMP12 P39900 2/20 0.39
MMP1 P03956 1/20 0.39
MMP9 P14780 1/20 0.39
MAPT P10636 1/20 0.39
CYP1A2 P05177 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
SCHEMBL279194 0.95 ALDH1A1 (0.47) ALDH1A1NPC1GAASMN1; SMN2KDM4E
SCHEMBL279578 0.94 ALDH1A1 (0.43) ALDH1A1NPC1GAASMN1; SMN2KDM4E
SCHEMBL12316661 0.91 NPC1 (0.43) ALDH1A1NPC1GAASMN1; SMN2KDM4E
SCHEMBL279176 0.90 MMP12 (0.41) ALDH1A1NPC1GAASMN1; SMN2KDM4E
SCHEMBL279306 0.89 ALDH1A1 (0.51) ALDH1A1NPC1GAASMN1; SMN2KDM4E
SCHEMBL25509839 0.86 NPC1 (0.51) ALDH1A1NPC1GAAMAPK1RAB9A
SCHEMBL22699958 0.86 ALDH1A1 (0.52) ALDH1A1NPC1GAASMN1; SMN2RAB9A
SCHEMBL279338 0.83 ALDH1A1 (0.48) ALDH1A1NPC1GAASMN1; SMN2KDM4E
SCHEMBL15080664 0.83 ALDH1A1 (0.48) ALDH1A1NPC1GAASMN1; SMN2HPGD
SCHEMBL279308 0.83 ALDH1A1 (0.48) ALDH1A1NPC1GAASMN1; SMN2KDM4E

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-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