SCHEMBL16319732

SCHEMBL16319732

COC(=O)c1ccc(Oc2ccc(Cl)c(C(F)(F)F)c2)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.48
NOTUM Q6P988 2/20 0.48
RAF1 P04049 6/20 0.47
BRAF P15056 5/20 0.47
HDAC1 Q13547 3/20 0.47
HDAC3 O15379 2/20 0.47
HDAC4 P56524 2/20 0.47
HDAC7 Q8WUI4 2/20 0.47
HDAC2 Q92769 2/20 0.47
HDAC10 Q969S8 2/20 0.47
HDAC11 Q96DB2 2/20 0.47
HDAC8 Q9BY41 2/20 0.47
HDAC6 Q9UBN7 2/20 0.47
HDAC9 Q9UKV0 2/20 0.47
HDAC5 Q9UQL6 2/20 0.47
ARAF P10398 2/20 0.47
KDR P35968 4/20 0.45
MEN1 O00255 1/20 0.44
PLK4 O00444 1/20 0.44
CIT O14578 1/20 0.44

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
SCHEMBL371059 0.85 RAF1 (0.44) SCN9ANOTUMRAF1BRAFHDAC1
SCHEMBL364772 0.85 RAF1 (0.53) SCN9ANOTUMRAF1BRAFHDAC1
SCHEMBL16319316 0.85 PPARG (0.49) SCN9ANOTUMRAF1BRAFHDAC1
SCHEMBL28665319 0.82 AR (0.51) KDRMEN1ABL1FLT1CCNC
SCHEMBL16319642 0.81 SCN9A (0.57) SCN9ARAF1BRAFHDAC1HDAC3
SCHEMBL3139349 0.80 HPGD (0.47) SCN9AABL1MAPK1SLC6A3KMT2A
SCHEMBL21434767 0.80 PDK2 (0.47) SCN9AABL1EPHX2CA7CA9
SCHEMBL16319791 0.79 BRAF (0.52) SCN9ARAF1BRAFHDAC1HDAC3
SCHEMBL16319640 0.79 BRAF (0.57) SCN9ARAF1BRAFHDAC1HDAC3
SCHEMBL27645324 0.79 CA12 (0.51) MEN1ABL1CA7KMT2ACA9

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