SCHEMBL8944022

SCHEMBL8944022

COc1ccc(Nc2cccc(SCCCCSc3cccc(Nc4ccc(OC)cc4)c3Nc3ccc(OC)cc3)c2Nc2ccc(OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
RAB9A P51151 8/20 0.48
KMT2A Q03164 7/20 0.46
MEN1 O00255 6/20 0.46
MAPT P10636 4/20 0.46
KDM4E B2RXH2 3/20 0.46
GAA P10253 2/20 0.46
THRB P10828 2/20 0.46
RECQL P46063 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
MAPK1 P28482 2/20 0.46
HSD17B10 Q99714 2/20 0.46
HTT P42858 2/20 0.46
MMP14 P50281 1/20 0.46
ALOX12 P18054 1/20 0.46
NPC1 O15118 6/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
POLB P06746 3/20 0.40
LMNA P02545 2/20 0.40

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
SCHEMBL8943763 0.94 ALDH1A1 (0.51) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL8944102 0.85 ALDH1A1 (0.43) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL8943970 0.81 ALDH1A1 (0.42) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL8944019 0.77 MAPT (0.50) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL8943887 0.74 ALDH1A1 (0.51) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL8944399 0.73 ALDH1A1 (0.50) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL8943587 0.72 ALDH1A1 (0.53) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL8944281 0.72 ALDH1A1 (0.53) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL7634189 0.72 RAB9A (0.55) ALDH1A1RAB9AKMT2AMEN1MAPT
SCHEMBL11896054 0.72 MEN1 (0.63) ALDH1A1RAB9AKMT2AMEN1MAPT

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