SCHEMBL16320297

SCHEMBL16320297

COC(=O)c1ccc(Oc2ccc(Cl)c(C(F)(F)F)c2)c(Cl)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 1/20 0.52
SCN9A Q15858 7/20 0.51
NOTUM Q6P988 2/20 0.49
PLA2G7 Q13093 2/20 0.48
KDR P35968 1/20 0.45
MRGPRX4 Q96LA9 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
MAPT P10636 1/20 0.45
SCN5A Q14524 1/20 0.45
PDK1 Q15118 2/20 0.44
PDK2 Q15119 2/20 0.44
PDK3 Q15120 2/20 0.44
PDK4 Q16654 2/20 0.44
HDAC3 O15379 1/20 0.44
RAF1 P04049 1/20 0.44
ARAF P10398 1/20 0.44
BRAF P15056 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 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
SCHEMBL16319599 0.90 SCN9A (0.52) SCN9ANOTUMPLA2G7KDRMRGPRX4
SCHEMBL364772 0.87 RAF1 (0.53) SCN9ANOTUMKDRLMNAGAA
SCHEMBL16319785 0.86 PLA2G7 (0.55) ESRRASCN9APLA2G7MRGPRX4RAF1
SCHEMBL197395 0.84 NOTUM (0.62) NOTUMKDRMRGPRX4LMNAGAA
SCHEMBL16319487 0.82 SCN9A (0.65) ESRRASCN9APLA2G7MRGPRX4SCN5A
SCHEMBL370483 0.80 USP2 (0.49) ESRRASCN9ALMNAMAPTUSP2
SCHEMBL16319732 0.78 SCN9A (0.48) SCN9ANOTUMKDRLMNAGAA
SCHEMBL28144725 0.78 NOTUM (0.67) NOTUMMRGPRX4LMNAGAAMAPT
SCHEMBL27534851 0.77 TTR (0.54) MRGPRX4GAAMAPTUSP2
SCHEMBL14649867 0.77 AR (0.53) ESRRASCN9APLA2G7

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