SCHEMBL8943983

SCHEMBL8943983

COc1ccc(Nc2ccc(OCCOc3cccc(Nc4ccc(C)cc4)c3Nc3ccc(C)cc3)c(Nc3ccc(OC)cc3)c2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 6/20 0.43
KMT2A Q03164 6/20 0.43
RAB9A P51151 5/20 0.43
NPC1 O15118 3/20 0.43
RAPGEF4 Q8WZA2 1/20 0.40
EGFR P00533 2/20 0.40
ERBB3 P21860 2/20 0.40
ACP1 P24666 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
MAPT P10636 3/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
THRB P10828 2/20 0.39
MAPK1 P28482 2/20 0.39
RECQL P46063 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL8943993 0.92 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8944086 0.89 MAPT (0.49) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8943587 0.87 ALDH1A1 (0.53) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8943581 0.84 MAPT (0.55) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8943773 0.84 MAPT (0.45) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8943887 0.83 ALDH1A1 (0.51) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8944399 0.81 ALDH1A1 (0.50) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8944343 0.81 ALDH1A1 (0.46) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8944014 0.81 HPGD (0.42) ALDH1A1MEN1KMT2ARAB9ANPC1
SCHEMBL8943909 0.80 MEN1 (0.56) MEN1KMT2ARAB9ANPC1RAPGEF4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5480765-A PRESSURE AND HEAT SENSITIVE PAPER, IMPROVED PHOTOSTABILITY BY ADDITION OF TRIARYLAMINE COMPOUND FUJI PHOTO FILM CO., LTD. (JP) 1996-01-02 US disclosed