SCHEMBL4783140

SCHEMBL4783140

Cc1ncc(Nc2cc(C#N)cc(C(C)(C)C)c2)cc1-n1cc(C(=O)NN2CCOCC2)nn1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.36
NR1I2 O75469 1/20 0.36
BRAF P15056 18/20 0.35
RAF1 P04049 16/20 0.35

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
SCHEMBL4780817 0.92 NR1I2 (0.36) NR1I2
SCHEMBL4782033 0.84 NR1I2 (0.35) NR1I2
SCHEMBL4779207 0.83 NR1I2 (0.38) NR1I2
SCHEMBL4782863 0.83 NR1I2 (0.40) MAPK14NR1I2BRAFRAF1
SCHEMBL4779570 0.82 SSTR4 (0.40) NR1I2BRAF
SCHEMBL4781607 0.82 ACKR3 (0.41) NR1I2
SCHEMBL4782188 0.81 MEN1 (0.42) MAPK14NR1I2
SCHEMBL4780707 0.81 NR1I2 (0.36) NR1I2
SCHEMBL4780027 0.81 NR1I2 (0.36) NR1I2
SCHEMBL4783774 0.81 NR1I2 (0.36) NR1I2

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