SCHEMBL14727192

SCHEMBL14727192

C=Cc1ccc(COCc2ccc(N(c3ccc(COCc4ccc(C=C)cc4)cc3)c3ccc(C(=O)OCCOC(=O)c4ccc(N(c5ccc(COCc6ccc(C=C)cc6)cc5)c5ccc(COCc6ccc(C=C)cc6)cc5)cc4)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
TSHR P16473 4/20 0.43
NPC1 O15118 4/20 0.43
HPGD P15428 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 2/20 0.43
GAA P10253 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPT P10636 4/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
ESR1 P03372 4/20 0.40
SLC6A2 P23975 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CHRM1 P11229 1/20 0.40
KDR P35968 1/20 0.40
ESR2 Q92731 2/20 0.40
RAB9A P51151 3/20 0.39
LMNA P02545 3/20 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
SCHEMBL14727158 0.95 ALDH1A1 (0.46) ALDH1A1TSHRNPC1HPGDSMN1; SMN2
SCHEMBL14730136 0.91 CA12 (0.48) ALDH1A1TSHRNPC1HPGDSMN1; SMN2
SCHEMBL14727151 0.90 ALDH1A1 (0.39) ALDH1A1TSHRNPC1HPGDSMN1; SMN2
SCHEMBL23731591 0.84 MAPT (0.57) ALDH1A1TSHRNPC1HPGDSMN1; SMN2
SCHEMBL15292542 0.84 MAPT (0.57) ALDH1A1TSHRNPC1HPGDSMN1; SMN2
SCHEMBL14113931 0.84 MEN1 (0.55) ALDH1A1TSHRNPC1SMN1; SMN2KDM4E
SCHEMBL14727195 0.83 ALDH1A1 (0.42) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL14727171 0.82 MAPT (0.36) ALDH1A1TSHRNPC1HPGDSMN1; SMN2
SCHEMBL14730137 0.82 ALDH1A1 (0.43) ALDH1A1HPGD
SCHEMBL14727190 0.81 ALDH1A1 (0.38) ALDH1A1TSHRESR1ESR2

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