SCHEMBL20145566

SCHEMBL20145566

CC1CCC(c2cnc(N)c(-c3ccc(C(=O)NCc4cccc(Cl)c4)c(F)c3)n2)CC1

nearest known ligand 0.82

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.82

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
SCHEMBL20145607 0.93 MAPK1 (0.84) MAPK1
SCHEMBL20145587 0.93 MAPK1 (0.84) MAPK1
SCHEMBL20145540 0.92 MAPK1 (0.85) MAPK1
SCHEMBL20145507 0.91 MAPK1 (0.78) MAPK1
SCHEMBL20145541 0.91 MAPK1 (0.80) MAPK1
SCHEMBL16680464 0.90 MAPK1 (1.00) MAPK1
SCHEMBL20145616 0.90 MAPK1 (0.77) MAPK1
SCHEMBL20145487 0.88 MAPK1 (0.77) MAPK1
SCHEMBL20145434 0.88 MAPK1 (0.76) MAPK1
SCHEMBL20145505 0.87 MAPK1 (0.76) 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