SCHEMBL4778697

SCHEMBL4778697

Cc1ncc(NC(=O)c2cc(C#N)cc(C(C)(C)C)c2)cc1-c1ccc(C(=O)N2CC3C4CCC(O4)C3C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 20/20 0.42
BRAF P15056 19/20 0.42

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
SCHEMBL4729113 0.85 RAF1 (0.45) RAF1BRAF
SCHEMBL4782670 0.84 RAF1 (0.39) RAF1BRAF
SCHEMBL4725070 0.81 TEK (0.46) RAF1BRAF
SCHEMBL4729206 0.80 RAF1 (0.47) RAF1BRAF
SCHEMBL4725881 0.80 RAF1 (0.42) RAF1BRAF
SCHEMBL4726247 0.80 RAF1 (0.43) RAF1BRAF
SCHEMBL4727147 0.80 MAPK14 (0.48) RAF1BRAF
SCHEMBL4728995 0.79 RAF1 (0.53) RAF1BRAF
SCHEMBL4727842 0.79 RAF1 (0.45) RAF1BRAF
SCHEMBL4726220 0.79 RAF1 (0.41) RAF1BRAF

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
WO-2008021388-A1 HETEROARYL DERIVATIVES AS CYTOKINE INHIBITORS KEMIA, INC. (US) 2008-02-21 WO disclosed