SCHEMBL5592958

SCHEMBL5592958

Cc1ccc(NC(=O)c2cc(F)cc(N3CCOCC3)c2)cc1C1=CCON1Cc1cccnc1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.54
MAPK13 O15264 1/20 0.54
MAPK12 P53778 1/20 0.54
MAPK11 Q15759 1/20 0.54
RAF1 P04049 2/20 0.53
BRAF P15056 2/20 0.53
TP53 P04637 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL5593303 0.83 RAF1 (0.59) MAPK14RAF1BRAF
SCHEMBL5603999 0.81 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL5592959 0.79 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL4551494 0.79 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL4417398 0.77 TEK (0.54) RAF1BRAF
SCHEMBL4410223 0.75 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL4411272 0.75 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL6079594 0.75 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11BRAF
SCHEMBL4727303 0.74 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11RAF1
SCHEMBL5593445 0.74 RAF1 (0.58) MAPK14RAF1BRAF

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-2007075896-A2 HETEROCYCLIC CYTOKINE INHIBITORS KEMIA, INC. (US) 2007-07-05 WO disclosed