SCHEMBL680462

SCHEMBL680462

Cc1ccc(Oc2ccc(C(=O)NS(C)(=O)=O)cc2F)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 13/20 0.50
IGFBP3 P17936 1/20 0.46
MMP13 P45452 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
SCN2B O60939 1/20 0.43
SCN1B Q07699 1/20 0.43
SCN5A Q14524 1/20 0.43
PTPN1 P18031 1/20 0.43
KCNQ3 O43525 1/20 0.42
KCNQ2 O43526 1/20 0.42
KCNE1 P15382 1/20 0.42
KCNQ1 P51787 1/20 0.42
LMNA P02545 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
SCHEMBL679975 0.89 SCN9A (0.56) SCN9AIGFBP3SCN2BSCN1BSCN5A
SCHEMBL679043 0.88 SCN9A (0.51) SCN9ASCN2BSCN1BSCN5A
SCHEMBL21628451 0.87 HDAC1 (0.56) IGFBP3MMP13MAPTMAPK1KCNQ3
SCHEMBL679029 0.85 SCN9A (0.56) SCN9A
SCHEMBL680642 0.85 SCN9A (0.50) SCN9AMMP13MAPTMAPK1SCN5A
SCHEMBL1690181 0.84 SCN9A (0.50) SCN9ASCN5AKCNQ3KCNQ2KCNE1
SCHEMBL16319310 0.84 SCN9A (0.71) SCN9AIGFBP3SCN5A
SCHEMBL21656765 0.84 MMP13 (0.65) IGFBP3MMP13MAPTMAPK1KCNQ3
SCHEMBL680213 0.82 SCN9A (0.54) SCN9ASCN2BSCN1BSCN5APTPN1
SCHEMBL680082 0.82 SCN9A (0.72) SCN9ASCN2BSCN1BSCN5A

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 13/4885IGFBP3 4773/4885MMP13 4543/4885

“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.