SCHEMBL680001

SCHEMBL680001

COc1ccc(Oc2ccc(C(=O)NS(C)(=O)=O)cc2)c(F)c1F

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 15/20 0.51
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
SCN5A Q14524 1/20 0.42
MEN1 O00255 1/20 0.42
RAB9A P51151 1/20 0.42
KMT2A Q03164 1/20 0.42
TP53 P04637 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL678866 0.86 SCN9A (0.53) SCN9ASCN5AMEN1RAB9AKMT2A
SCHEMBL679939 0.83 MEN1 (0.60) SCN9ACA1CA2MEN1RAB9A
SCHEMBL681087 0.83 SCN9A (0.54) SCN9ASCN5A
SCHEMBL680757 0.82 SCN9A (0.53) SCN9AMAPTMEN1RAB9AKMT2A
SCHEMBL678507 0.82 SCN9A (0.53) SCN9AMAPTMEN1RAB9AKMT2A
SCHEMBL680791 0.81 CA1 (0.61) MAPTCA1CA2MEN1RAB9A
SCHEMBL678799 0.81 SCN9A (0.56) SCN9ASCN5AMEN1KMT2A
SCHEMBL703171 0.80 BCL2L1 (0.59) SCN9ASCN5A
SCHEMBL16319623 0.80 SCN9A (0.46) SCN9ASCN5A
SCHEMBL16319538 0.80 SLC6A4 (0.50) SCN9ASCN5A

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 2 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
US-20120010207-A1 Chemical Compounds PFIZER LIMITED (GB) 2012-01-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120010207-A1 Chemical Compounds SCN1A, SCN1B, SCN7A SCN9A 13/4885KDM4E 3006/4885MAPT 3240/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.