SCHEMBL20136102

SCHEMBL20136102

Nc1ncc([C@H]2CCC[C@H](O)C2)nc1-c1ccc(C(=O)N[C@H](CO)c2cccc(Cl)c2)c(F)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
SCHEMBL16680406 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16680408 1.00 MAPK1 (1.00) MAPK1
SCHEMBL20136103 1.00 MAPK1 (1.00) MAPK1
SCHEMBL20145575 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679115 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679597 0.96 MAPK1 (1.00) MAPK1
SCHEMBL20145546 0.96 MAPK1 (1.00) MAPK1
SCHEMBL21244145 0.94 MAPK1 (1.00) MAPK1
SCHEMBL16679907 0.94 MAPK1 (1.00) MAPK1
SCHEMBL16680628 0.92 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