SCHEMBL21167583

SCHEMBL21167583

Cn1cc(-c2ccc(NN)c(NCc3ccc4nccn4c3)n2)cn1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.49
MKNK1 Q9BUB5 4/20 0.45
CSF1R P07333 1/20 0.41
NQO2 P16083 1/20 0.41
KEAP1 Q14145 1/20 0.39
PAK1 Q13153 1/20 0.37
IRAK1 P51617 1/20 0.36
IRAK4 Q9NWZ3 1/20 0.36
MAPT P10636 1/20 0.35
NAMPT P43490 1/20 0.35
TRIM33 Q9UPN9 1/20 0.35

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
SCHEMBL23128064 0.89 MET (0.44) METMKNK1CSF1RNQO2KEAP1
SCHEMBL22475697 0.88 MET (0.51) METMKNK1CSF1RNQO2KEAP1
SCHEMBL22475857 0.88 MET (0.38) METMKNK1NQO2KEAP1PAK1
SCHEMBL22475713 0.88 MET (0.53) METMKNK1KEAP1PAK1NAMPT
SCHEMBL21167340 0.87 MET (0.55) METMKNK1CSF1RNQO2KEAP1
SCHEMBL22475870 0.84 MET (0.53) METMKNK1CSF1RKEAP1PAK1
SCHEMBL21167421 0.84 CSF1R (0.59) METMKNK1CSF1RNQO2KEAP1
SCHEMBL21167410 0.83 MKNK1 (0.51) METMKNK1KEAP1PAK1NAMPT
SCHEMBL24591117 0.80 MET (0.53) METMKNK1CSF1RNQO2KEAP1
SCHEMBL24591043 0.77 MET (0.54) METMKNK1KEAP1PAK1NAMPT

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
EP-3511330-A1 SYNTHETIC INTERMEDIATE USEFUL IN THE PREPARATION OF TRIAZOLOPYRIDINE C-MET INHIBITORS Hutchison Medipharma Limited (CN) 2019-07-17 EP disclosed