SCHEMBL14727158

SCHEMBL14727158

C=Cc1ccc(COCc2ccc(N(c3ccccc3)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 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
MAPT P10636 4/20 0.46
HPGD P15428 3/20 0.46
ESR1 P03372 2/20 0.45
ESR2 Q92731 1/20 0.45
LMNA P02545 2/20 0.42
KMT2A Q03164 3/20 0.41
TDP1 Q9NUW8 3/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A3 Q01959 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
KDM4E B2RXH2 2/20 0.40
GAA P10253 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.38
CHRM1 P11229 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
SCHEMBL14727192 0.95 ALDH1A1 (0.43) ALDH1A1MAPTHPGDESR1ESR2
SCHEMBL15292542 0.90 MAPT (0.57) ALDH1A1MAPTHPGDESR1ESR2
SCHEMBL23731591 0.90 MAPT (0.57) ALDH1A1MAPTHPGDESR1ESR2
SCHEMBL14730137 0.88 ALDH1A1 (0.43) ALDH1A1HPGD
SCHEMBL14730136 0.86 CA12 (0.48) ALDH1A1MAPTHPGDESR1ESR2
SCHEMBL14727151 0.85 ALDH1A1 (0.39) ALDH1A1MAPTHPGDESR1ESR2
SCHEMBL27941780 0.85 ESR1 (0.55) ALDH1A1MAPTHPGDESR1ESR2
SCHEMBL14727177 0.84 TSHR (0.45) ALDH1A1MAPTLMNAKMT2ATDP1
SCHEMBL14727163 0.83 TSHR (0.41) ALDH1A1MAPTLMNAKMT2ATDP1
SCHEMBL13777509 0.81 TSHR (0.41) ALDH1A1MAPTHPGDKMT2ATDP1

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-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