SCHEMBL16319640

SCHEMBL16319640

NC(=O)c1ccc(Oc2ccc(Cl)c(C(F)(F)F)c2)cc1C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.57
HDAC1 Q13547 3/20 0.57
HDAC3 O15379 2/20 0.57
HDAC4 P56524 2/20 0.57
HDAC7 Q8WUI4 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC10 Q969S8 2/20 0.57
HDAC11 Q96DB2 2/20 0.57
HDAC8 Q9BY41 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
HDAC9 Q9UKV0 2/20 0.57
HDAC5 Q9UQL6 2/20 0.57
CHEK2 O96017 1/20 0.52
RAF1 P04049 3/20 0.51
SCN9A Q15858 4/20 0.50
ARAF P10398 1/20 0.47
MAPK8 P45983 1/20 0.47
MAPK10 P53779 1/20 0.47
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46

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
SCHEMBL16319791 0.88 BRAF (0.52) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL16319405 0.87 BRAF (0.51) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL364213 0.85 CHEK2 (0.64) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL16319316 0.82 PPARG (0.49) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL16320136 0.81 SCN9A (0.61) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL16319795 0.81 SCN9A (0.55) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL364276 0.80 SCN9A (0.54) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL16319516 0.79 SCN9A (0.48) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL16319732 0.79 SCN9A (0.48) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL5460005 0.78 MAPK10 (0.53) MAPK8MAPK10CA1CA2

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