SCHEMBL20145832

SCHEMBL20145832

NCC(NC(=O)c1ccc(-c2nc(C3CC[C@H](O)[C@H](F)C3)cnc2N)cc1F)c1cc(F)cc(Br)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
SCHEMBL21244140 1.00 MAPK1 (1.00) MAPK1
SCHEMBL19813098 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679634 1.00 MAPK1 (1.00) MAPK1
SCHEMBL19812915 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679169 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679481 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679457 0.95 MAPK1 (1.00) MAPK1
SCHEMBL16680345 0.95 MAPK1 (1.00) MAPK1
SCHEMBL21244173 0.95 MAPK1 (1.00) MAPK1
SCHEMBL16680004 0.95 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