SCHEMBL20145810

SCHEMBL20145810

CO[C@H]1CCCC(c2cnc(N)c(-c3ccc(C(=O)N[C@H](CO)c4cccc(Cl)c4)c(F)c3)n2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 20/20 1.00

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
SCHEMBL19812964 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16690866 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679744 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679742 1.00 MAPK1 (1.00) MAPK1
SCHEMBL19812963 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16692521 0.91 MAPK1 (0.83) MAPK1
SCHEMBL16680408 0.90 MAPK1 (1.00) MAPK1
SCHEMBL20145575 0.90 MAPK1 (1.00) MAPK1
SCHEMBL16679115 0.90 MAPK1 (1.00) MAPK1
SCHEMBL16680406 0.90 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