SCHEMBL680642

SCHEMBL680642

Cc1ccc(F)c(Oc2ccc(C(=O)NS(C)(=O)=O)cc2)c1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 14/20 0.50
SCN5A Q14524 1/20 0.45
MMP13 P45452 1/20 0.44
MRGPRX1 Q96LB2 2/20 0.43
PTPN1 P18031 1/20 0.43
MAPT P10636 1/20 0.41
MAPK1 P28482 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
SCHEMBL679902 0.88 SCN9A (0.56) SCN9ASCN5APTPN1
SCHEMBL678839 0.87 PPARA (0.47) SCN9AMMP13MRGPRX1PTPN1
SCHEMBL680462 0.85 SCN9A (0.50) SCN9ASCN5AMMP13PTPN1MAPT
SCHEMBL678837 0.85 SCN9A (0.59) SCN9AMMP13
SCHEMBL365526 0.85 SCN9A (0.54) SCN9AMMP13
SCHEMBL680757 0.85 SCN9A (0.53) SCN9AMMP13MRGPRX1MAPTMAPK1
SCHEMBL678507 0.85 SCN9A (0.53) SCN9AMMP13MRGPRX1MAPTMAPK1
SCHEMBL680062 0.84 MMP13 (0.47) SCN9AMMP13PTPN1MAPTMAPK1
SCHEMBL680159 0.83 CXCL8 (0.59) SCN9ASCN5AMMP13PTPN1
SCHEMBL680561 0.82 MMP13 (0.65) SCN9AMMP13MAPT

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 13/4885SCN5A 5/4885MMP13 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.