SCHEMBL20136110

SCHEMBL20136110

[2H]C1([2H])CC(c2cnc(N)c(-c3ccc(C(=O)NC(CO)c4ccccc4)cc3)n2)CC([2H])([2H])O1

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 0.84

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
SCHEMBL16680336 1.00 MAPK1 (0.84) MAPK1
SCHEMBL16679303 0.91 MAPK1 (1.00) MAPK1
SCHEMBL16679306 0.91 MAPK1 (1.00) MAPK1
SCHEMBL16679693 0.88 MAPK1 (1.00) MAPK1
SCHEMBL28830823 0.88 MAPK1 (1.00) MAPK1
SCHEMBL16680085 0.88 MAPK1 (1.00) MAPK1
SCHEMBL16679689 0.88 MAPK1 (1.00) MAPK1
SCHEMBL20136104 0.88 MAPK1 (1.00) MAPK1
SCHEMBL19039744 0.84 MAPK1 (0.67) MAPK1
SCHEMBL16679271 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