SCHEMBL20145637

SCHEMBL20145637

COC(=O)N1CCCC(c2cnc(N)c(-c3ccc(C(=O)NCc4cccc(Cl)c4)c(F)c3)n2)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
SCHEMBL20145434 0.92 MAPK1 (0.76) MAPK1
SCHEMBL20145540 0.87 MAPK1 (0.85) MAPK1
SCHEMBL28076630 0.86 MAPK1 (1.00) MAPK1
SCHEMBL16679965 0.86 MAPK1 (1.00) MAPK1
SCHEMBL20145541 0.86 MAPK1 (0.80) MAPK1
SCHEMBL20145544 0.86 MAPK1 (0.85) MAPK1
SCHEMBL20145566 0.84 MAPK1 (0.82) MAPK1
SCHEMBL20145616 0.84 MAPK1 (0.77) MAPK1
SCHEMBL20145487 0.84 MAPK1 (0.77) MAPK1
SCHEMBL16679180 0.84 MAPK1 (0.74) 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