SCHEMBL14727151

SCHEMBL14727151

C=Cc1ccc(COCc2ccc(N(c3ccc(C(=O)OCCOC(=O)c4ccc(N(c5ccc(COCc6ccc(C=C)cc6)cc5)c5ccc(C)c(C)c5)cc4)cc3)c3ccc(C)c(C)c3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
HPGD P15428 3/20 0.39
NPC1 O15118 3/20 0.39
TSHR P16473 3/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPK1 P28482 2/20 0.39
GAA P10253 1/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPT P10636 7/20 0.38
ESR1 P03372 3/20 0.36
CHRM1 P11229 1/20 0.36
SLC6A2 P23975 1/20 0.36
KDR P35968 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
KCNH2 Q12809 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35

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
SCHEMBL14727133 0.92 TSHR (0.38) ALDH1A1SMN1; SMN2TSHRMAPK1MAPT
SCHEMBL14727171 0.92 MAPT (0.36) ALDH1A1SMN1; SMN2HPGDNPC1TSHR
SCHEMBL14727192 0.90 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2HPGDNPC1TSHR
SCHEMBL14730136 0.86 CA12 (0.48) ALDH1A1SMN1; SMN2HPGDNPC1TSHR
SCHEMBL14727159 0.86 ALDH1A1 (0.33) ALDH1A1MAPTMEN1KMT2ATP53
SCHEMBL14727158 0.85 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2HPGDNPC1TSHR
SCHEMBL13840020 0.83 KCNH2 (0.32) KCNH2MEN1KMT2A
SCHEMBL14727157 0.82 KCNH2 (0.32) KCNH2
SCHEMBL14727138 0.82 KCNH2 (0.32) KCNH2
SCHEMBL14727164 0.81 ALOX5 (0.32) MAPT

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-8663883-B2 Charge-transporting film, photoelectric conversion device, electrophotographic photoreceptor, process cartridge, and image forming apparatus FUJI XEROX CO., LTD. (JP) 2014-03-04 US disclosed
US-8663883-B2 Charge-transporting film, photoelectric conversion device, electrophotographic photoreceptor, process cartridge, and image forming apparatus FUJI XEROX CO., LTD. (JP) 2014-03-04 US disclosed
US-20130052570-A1 CHARGE-TRANSPORTING FILM, PHOTOELECTRIC CONVERSION DEVICE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2013-02-28 US disclosed
US-20130052570-A1 CHARGE-TRANSPORTING FILM, PHOTOELECTRIC CONVERSION DEVICE, ELECTROPHOTOGRAPHIC PHOTORECEPTOR, PROCESS CARTRIDGE, AND IMAGE FORMING APPARATUS FUJI XEROX CO., LTD. (JP) 2013-02-28 US disclosed