SCHEMBL16319405

SCHEMBL16319405

CCc1cc(Oc2ccc(Cl)c(C(F)(F)F)c2)ccc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.51
HDAC1 Q13547 3/20 0.51
HDAC3 O15379 2/20 0.51
HDAC4 P56524 2/20 0.51
HDAC7 Q8WUI4 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC10 Q969S8 2/20 0.51
HDAC11 Q96DB2 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
HDAC9 Q9UKV0 2/20 0.51
HDAC5 Q9UQL6 2/20 0.51
CHEK2 O96017 1/20 0.47
RAF1 P04049 4/20 0.46
SCN9A Q15858 4/20 0.45
ARAF P10398 1/20 0.44
PPARG P37231 2/20 0.44
PPARA Q07869 2/20 0.44
MAPK8 P45983 1/20 0.42
MAPK10 P53779 1/20 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
SCHEMBL16319640 0.87 BRAF (0.57) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL16319791 0.84 BRAF (0.52) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL12806908 0.79 SCN9A (0.46) BRAFHDAC1RAF1SCN9APPARG
SCHEMBL364213 0.79 CHEK2 (0.64) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL363401 0.78 PPARG (0.45) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL371059 0.77 RAF1 (0.44) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL12806673 0.76 PPARG (0.44) BRAFHDAC1CHEK2RAF1SCN9A
SCHEMBL16319334 0.76 AR (0.59)
SCHEMBL16319316 0.76 PPARG (0.49) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL366843 0.76 SCN9A (0.49) BRAFHDAC1HDAC3HDAC4HDAC7

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-2593427-B1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LTD (GB) 2014-12-24 EP disclosed