SCHEMBL7981759

SCHEMBL7981759

Clc1ccc(Nc2ccccn2)cc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.63
MEN1 O00255 5/20 0.63
RAB9A P51151 2/20 0.63
NPC1 O15118 1/20 0.63
GRM4 Q14833 2/20 0.55
MAPK10 P53779 1/20 0.50
GFER P55789 1/20 0.50
NPSR1 Q6W5P4 2/20 0.49
POLA1 P09884 1/20 0.49
KMO O15229 1/20 0.48
MAPT P10636 5/20 0.47
ALDH1A1 P00352 2/20 0.47
HPGD P15428 1/20 0.47
GLA P06280 1/20 0.47
HTT P42858 1/20 0.47
KDR P35968 1/20 0.46
JAK2 O60674 1/20 0.46
JAK1 P23458 1/20 0.46
TYK2 P29597 1/20 0.46
GAA P10253 1/20 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
SCHEMBL31220846 1.00 KMT2A (0.63) KMT2AMEN1RAB9ANPC1GRM4
Acetic Acid SCHEMBL9839206 0.87 KMT2A (0.61) KMT2AMEN1RAB9ANPC1GRM4
SCHEMBL28415105 0.85 EGFR (0.52) KMT2AMEN1RAB9ANPC1GRM4
SCHEMBL3038970 0.85 PIM1 (0.52) KMT2AMEN1RAB9ANPC1GRM4
SCHEMBL29408384 0.85 EGFR (0.52) KMT2AMEN1RAB9ANPC1GRM4
SCHEMBL25453077 0.85 MEN1 (0.48) KMT2AMEN1RAB9ANPC1GRM4
SCHEMBL30502751 0.85 MEN1 (0.48) KMT2AMEN1RAB9ANPC1GRM4
SCHEMBL7765065 0.79 HDAC3 (0.55) KMT2AMEN1RAB9ANPC1GRM4
SCHEMBL21258999 0.79 NPC1 (0.60) KMT2AMEN1RAB9ANPC1MAPK10
SCHEMBL29850051 0.79 NPC1 (0.60) KMT2AMEN1RAB9ANPC1MAPK10

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-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed