SCHEMBL365782

SCHEMBL365782

COC(=O)c1ccc(Oc2ccc(Cl)c(Cl)c2)cc1F

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 9/20 0.52
KMO O15229 1/20 0.46
HSP90AA1 P07900 1/20 0.45
P2RX3 P56373 1/20 0.45
SCN5A Q14524 1/20 0.44
HTR2A P28223 2/20 0.43
SLC6A4 P31645 2/20 0.43
KCNH2 Q12809 2/20 0.43
ABL1 P00519 1/20 0.42
CPS1 P31327 2/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL17996051 0.87 P2RX3 (0.55) SCN9AP2RX3SLC6A4ABL1CPS1
SCHEMBL21274571 0.83 HPGD (0.52) SCN9AP2RX3SLC6A4CPS1
SCHEMBL16319184 0.83 KMO (0.56) SCN9AKMOHSP90AA1P2RX3SCN5A
SCHEMBL23386692 0.82 XDH (0.51) P2RX3CPS1TDP1
SCHEMBL3139349 0.81 HPGD (0.47) SCN9AP2RX3SLC6A4ABL1TDP1
SCHEMBL16319605 0.80 SCN9A (0.76) SCN9ASCN5A
SCHEMBL1554929 0.79 CPS1 (0.61) CPS1
SCHEMBL26965756 0.78 ALDH1A1 (0.48) P2RX3CPS1
SCHEMBL19898600 0.77 MRGPRX4 (0.46) KMOABL1
SCHEMBL22407112 0.77 CHEK2 (0.42) SCN9AKMOHSP90AA1HTR2ASLC6A4

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 3 patents. 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
EP-2593427-A1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN Pfizer Limited (GB) 2013-05-22 EP disclosed
WO-2012007883-A1 SULFONAMIDE DERIVATIVES AS NAV1.7 INHIBITORS FOR THE TREATMENT OF PAIN PFIZER LIMITED (GB) 2012-01-19 WO disclosed