SCHEMBL20145722

SCHEMBL20145722

Nc1ncc(C2CCOCC2)nc1-c1ccc(C(=O)NCc2cccc(Br)c2)c(F)c1

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.83

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
SCHEMBL16679212 0.91 MAPK1 (1.00) MAPK1
SCHEMBL16680464 0.90 MAPK1 (1.00) MAPK1
SCHEMBL20145499 0.87 MAPK1 (0.85) MAPK1
SCHEMBL20145550 0.84 MAPK1 (0.93) MAPK1
SCHEMBL16678989 0.84 MAPK1 (1.00) MAPK1
SCHEMBL16678990 0.84 MAPK1 (1.00) MAPK1
SCHEMBL16679342 0.84 MAPK1 (1.00) MAPK1
SCHEMBL16679702 0.84 MAPK1 (1.00) MAPK1
SCHEMBL16679002 0.83 MAPK1 (1.00) MAPK1
SCHEMBL16679001 0.83 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