SCHEMBL20145500

SCHEMBL20145500

Nc1ncc([C@H]2CC[C@H](O)[C@@H](O)C2)nc1-c1ccc(C(=O)NC(CO)c2cc(F)cc(I)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
SCHEMBL21244162 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16681169 1.00 MAPK1 (1.00) MAPK1
SCHEMBL21244148 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679988 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679524 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16679624 1.00 MAPK1 (1.00) MAPK1
SCHEMBL21244175 1.00 MAPK1 (1.00) MAPK1
SCHEMBL16681217 0.95 MAPK1 (1.00) MAPK1
SCHEMBL20903193 0.95 MAPK1 (1.00) MAPK1
SCHEMBL30378501 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