SCHEMBL14727161

SCHEMBL14727161

C=Cc1ccc(N(c2ccc(COCc3ccc(N(c4ccc(C=C)cc4)c4ccc(-c5ccccc5)cc4)cc3)cc2)c2ccc(-c3ccccc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.42
AGXT P21549 2/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.38
NAAA Q02083 2/20 0.38
HSP90AB1 P08238 1/20 0.38
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.36
HPGD P15428 2/20 0.35
TAAR1 Q96RJ0 2/20 0.35
GSTP1 P09211 1/20 0.34
PPARG P37231 1/20 0.34
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33

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
SCHEMBL13777509 0.97 TSHR (0.41) IDO1AGXTTSHRALDH1A1NAAA
SCHEMBL14727117 0.96 IDO1 (0.39) IDO1AGXTTSHRALDH1A1NAAA
SCHEMBL14727177 0.92 TSHR (0.45) TSHRALDH1A1POLBMAPTPPARG
SCHEMBL14727201 0.92 IDO1 (0.36) IDO1AGXTTSHRNAAAHSP90AB1
SCHEMBL14727143 0.92 NAAA (0.39) IDO1AGXTTSHRALDH1A1NAAA
SCHEMBL21527139 0.91 TSHR (0.50) IDO1AGXTTSHRALDH1A1NAAA
SCHEMBL14727155 0.89 NAAA (0.39) IDO1AGXTTSHRALDH1A1NAAA
SCHEMBL14727131 0.89 NAAA (0.39) IDO1AGXTTSHRALDH1A1NAAA
SCHEMBL14727195 0.89 ALDH1A1 (0.42) TSHRALDH1A1PPARG
SCHEMBL14727169 0.88 NAAA (0.35) IDO1AGXTTSHRALDH1A1NAAA

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