SCHEMBL16319690

SCHEMBL16319690

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

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 2/20 0.53
SCN9A Q15858 5/20 0.51
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
IGFBP3 P17936 2/20 0.47
BRAF P15056 2/20 0.46
KDR P35968 2/20 0.46
PPARG P37231 1/20 0.44
PPARA Q07869 1/20 0.44
AR P10275 1/20 0.44
MRGPRX4 Q96LA9 1/20 0.44
KMO O15229 1/20 0.44
EGLN1 Q9GZT9 1/20 0.43
CHEK2 O96017 1/20 0.43
RAF1 P04049 1/20 0.43
EPHX2 P34913 1/20 0.43

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
SCHEMBL16319785 0.90 PLA2G7 (0.55) PLA2G7SCN9APPARGPPARAMRGPRX4
SCHEMBL16319599 0.86 SCN9A (0.52) PLA2G7SCN9ALMNARAB9ABRAF
SCHEMBL16319575 0.85 KMO (0.60) SCN9ALMNAMAPK1HTTRAB9A
SCHEMBL365436 0.84 SCN9A (0.47) PLA2G7SCN9APPARGPPARAMRGPRX4
SCHEMBL365495 0.84 PLA2G7 (0.53) PLA2G7BRAFKDRPPARGPPARA
SCHEMBL16319499 0.82 SCN9A (0.63) PLA2G7SCN9AMRGPRX4
SCHEMBL16319437 0.82 KMO (0.56) PLA2G7HTTIGFBP3MRGPRX4KMO
SCHEMBL21656739 0.80 IGFBP3 (0.59) LMNAMAPK1HTTRAB9AIGFBP3
SCHEMBL16319441 0.80 SCN9A (0.51) PLA2G7SCN9ABRAFKDRPPARG
SCHEMBL364840 0.80 SCN9A (0.69) PLA2G7SCN9APPARGPPARA

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