SCHEMBL20008263

SCHEMBL20008263

C=C=C(Nc1ccc(C)c(C(=N)/C=C\c2ncc[nH]2)c1)c1ccnc(C(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.33
RAF1 P04049 6/20 0.33

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
SCHEMBL20008419 0.75 RAF1 (0.39) BRAFRAF1
SCHEMBL20010011 0.71 BRAF (0.48) BRAFRAF1
SCHEMBL20008527 0.63 RAF1 (0.36) BRAFRAF1
SCHEMBL20008232 0.62 RAF1 (0.34) BRAFRAF1
SCHEMBL20009217 0.59 RAF1 (0.39) BRAFRAF1
SCHEMBL20518208 0.58 NFE2L2 (0.45)
SCHEMBL20518125 0.57 TLK2 (0.42)
SCHEMBL24716509 0.57 LMNA (0.41)
SCHEMBL16118412 0.57 NPC1 (0.39)
SCHEMBL18719675 0.56 PRSS1 (0.41)

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