SCHEMBL15975360

SCHEMBL15975360

CN=Nc1ccc(N=Nc2ccc(N=Nc3ccccc3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.67
MAPT P10636 8/20 0.56
KMT2A Q03164 6/20 0.56
MEN1 O00255 5/20 0.56
RAB9A P51151 4/20 0.56
NPC1 O15118 3/20 0.56
PKM P14618 1/20 0.56
HTT P42858 1/20 0.56
TDP1 Q9NUW8 4/20 0.56
MAPK1 P28482 4/20 0.56
TSHR P16473 2/20 0.56
HSD17B10 Q99714 1/20 0.56
TRPA1 O75762 2/20 0.50
CASP3 P42574 2/20 0.47
SENP8 Q96LD8 2/20 0.47
SENP7 Q9BQF6 2/20 0.47
SENP6 Q9GZR1 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 2/20 0.46

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
SCHEMBL14088371 1.00 ALDH1A1 (0.67) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL14071894 1.00 ALDH1A1 (0.67) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL54928 0.94
SCHEMBL14948162 0.94
SCHEMBL252196 0.94
SCHEMBL13497403 0.88 MAPT (0.47) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL9418780 0.85 ALDH1A1 (0.92) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL17732555 0.85 MAPT (0.42) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL21023910 0.85 ALDH1A1 (0.92) ALDH1A1MAPTKMT2AMEN1RAB9A
SCHEMBL21024214 0.85 ALDH1A1 (0.92) ALDH1A1MAPTKMT2AMEN1RAB9A

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-8814341-B2 Ink, ink cartridge and ink jet recording method CANON KABUSHIKI KAISHA (JP) 2014-08-26 US disclosed