SCHEMBL14715546

SCHEMBL14715546

CNC(=O)Oc1ccc2nnc(Cc3cccc(-c4ncc(OCCOC)cn4)c3)n2n1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.41
PIM1 P11309 1/20 0.39
FYN P06241 2/20 0.34
CSF1R P07333 1/20 0.34
SLC5A1 P13866 1/20 0.33

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
SCHEMBL2452496 0.93 MET (0.40) METFYN
SCHEMBL2454427 0.92 MET (0.43) METPIM1FYN
SCHEMBL2456961 0.91 MET (0.38) METPIM1FYNSLC5A1
SCHEMBL14715654 0.91 MET (0.38) METPIM1FYN
SCHEMBL14715608 0.89 MET (0.40) METPIM1
SCHEMBL12245314 0.87 MET (0.42) METFYN
SCHEMBL14715539 0.87 MET (0.39) METFYN
SCHEMBL12224263 0.86 MET (0.43) METPIM1
SCHEMBL2454419 0.84 MET (0.45) MET
SCHEMBL12245596 0.83 FYN (0.41) METFYN

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-2367827-B1 3-(3-PYRIMIDINE-2-YL-BENZYL)-[1,2,4]TRIAZOLO [4,3-b]PYRIDAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2013-02-27 EP disclosed