SCHEMBL20145533

SCHEMBL20145533

Nc1ncc(C2C[C@H]3COC(=O)N3C2)cc1-c1ccc(C(=O)NCc2cccc(Cl)c2)c(F)c1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.76

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
SCHEMBL16679283 0.86 MAPK1 (1.00) MAPK1
SCHEMBL20145626 0.83 MAPK1 (0.74) MAPK1
SCHEMBL20145564 0.83 MAPK1 (0.74) MAPK1
SCHEMBL20145523 0.81 MAPK1 (0.75) MAPK1
SCHEMBL20145463 0.81 MAPK1 (0.73) MAPK1
SCHEMBL20145528 0.80 MAPK1 (0.75) MAPK1
SCHEMBL20145454 0.80 MAPK1 (0.84) MAPK1
SCHEMBL20145452 0.80 MAPK1 (0.74) MAPK1
SCHEMBL16680338 0.80 MAPK1 (1.00) MAPK1
SCHEMBL21244166 0.80 MAPK1 (1.00) MAPK1

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-3063143-B1 AMINOHETEROARYL BENZAMIDES AS KINASE INHIBITORS NOVARTIS AG (CH) 2018-05-16 EP disclosed