SCHEMBL20008238

SCHEMBL20008238

CCCc1nnc(-c2cc(NC)cnc2C)cc1N1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.37
BRAF P15056 18/20 0.37
RAF1 P04049 17/20 0.37

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
SCHEMBL20008289 0.83 RAF1 (0.37) BRAFRAF1
SCHEMBL20008211 0.81 BRAF (0.36) BRAFRAF1
SCHEMBL20009213 0.77 RAF1 (0.47) BRAFRAF1
SCHEMBL20008259 0.76 RAF1 (0.38) BRAFRAF1
SCHEMBL20009709 0.76 BRAF (0.39) BRAFRAF1
SCHEMBL20008326 0.74 RAF1 (0.39) BRAFRAF1
SCHEMBL20008422 0.74 PIK3CA (0.38) BRAFRAF1
SCHEMBL20008475 0.73 RAF1 (0.39) BRAFRAF1
SCHEMBL20008496 0.73 RAF1 (0.37) BRAFRAF1
SCHEMBL19529245 0.72 RAF1 (0.47) BRAFRAF1

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-3299367-A1 BIARYL AMIDE COMPOUNDS AS KINASE INHIBITORS Novartis AG (CH) 2018-03-28 EP disclosed