SCHEMBL20145644

SCHEMBL20145644

CNCC(NC(=O)c1ccc(-c2nc([C@H]3CC[C@H](OC)CC3)cnc2N)cc1F)c1cccc(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
SCHEMBL16679939 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679941 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16680572 0.93 MAPK1 (1.00) MAPK1
SCHEMBL16680573 0.93 MAPK1 (1.00) MAPK1
SCHEMBL16679373 0.92 MAPK1 (1.00) MAPK1
SCHEMBL16679374 0.92 MAPK1 (1.00) MAPK1
SCHEMBL16679480 0.92 MAPK1 (1.00) MAPK1
SCHEMBL16679975 0.92 MAPK1 (1.00) MAPK1
SCHEMBL16679978 0.92 MAPK1 (1.00) MAPK1
SCHEMBL16679478 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