SCHEMBL20145633

SCHEMBL20145633

Cn1nncc1-c1cnc(N)c(-c2ccc(C(=O)NCc3cccc(Br)c3)c(F)c2)c1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.74

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
SCHEMBL16680331 0.85 MAPK1 (1.00) MAPK1
SCHEMBL16679468 0.83 MAPK1 (1.00) MAPK1
SCHEMBL16679470 0.83 MAPK1 (1.00) MAPK1
SCHEMBL20145650 0.81 MAPK1 (0.71) MAPK1
SCHEMBL16679533 0.81 MAPK1 (0.68) MAPK1
SCHEMBL20145456 0.80 MAPK1 (0.71) MAPK1
SCHEMBL20145663 0.79 MAPK1 (0.70) MAPK1
SCHEMBL16679320 0.77 MAPK1 (1.00) MAPK1
SCHEMBL20145464 0.77 MAPK1 (0.73) MAPK1
SCHEMBL16679318 0.77 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