SCHEMBL20145473

SCHEMBL20145473

C=C(O)[C@@H](NC(=O)c1ccc(-c2cc(-c3cnn(C(C)C)c3)cnc2N)cc1F)c1cccc(S(C)(=O)=O)c1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.80

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
SCHEMBL16679579 0.89 MAPK1 (1.00) MAPK1
SCHEMBL16679577 0.89 MAPK1 (1.00) MAPK1
SCHEMBL16680033 0.81 MAPK1 (1.00) MAPK1
SCHEMBL16680031 0.81 MAPK1 (1.00) MAPK1
SCHEMBL16679222 0.81 MAPK1 (1.00) MAPK1
SCHEMBL16679219 0.81 MAPK1 (1.00) MAPK1
SCHEMBL16679685 0.79 MAPK1 (1.00) MAPK1
SCHEMBL16679684 0.79 MAPK1 (1.00) MAPK1
SCHEMBL16679806 0.79 MAPK1 (1.00) MAPK1
SCHEMBL16679807 0.79 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