SCHEMBL678839

SCHEMBL678839

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

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.47
MMP13 P45452 2/20 0.47
SCN9A Q15858 11/20 0.45
MRGPRX1 Q96LB2 3/20 0.43
SCN2B O60939 1/20 0.42
SCN1A P35498 1/20 0.42
SCN1B Q07699 1/20 0.42
P4HTM Q9NXG6 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
PTPN1 P18031 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
SCHEMBL680062 0.89 MMP13 (0.47) MMP13SCN9ASCN2BSCN1ASCN1B
SCHEMBL678837 0.87 SCN9A (0.59) MMP13SCN9A
SCHEMBL678507 0.87 SCN9A (0.53) MMP13SCN9AMRGPRX1
SCHEMBL680374 0.87 SCN9A (0.49) SCN9ASCN2BSCN1ASCN1BPTPN1
SCHEMBL680757 0.87 SCN9A (0.53) MMP13SCN9AMRGPRX1
SCHEMBL365526 0.87 SCN9A (0.54) MMP13SCN9A
SCHEMBL681070 0.87 SCN9A (0.58) SCN9ASCN2BSCN1ASCN1B
SCHEMBL680642 0.87 SCN9A (0.50) MMP13SCN9AMRGPRX1PTPN1
SCHEMBL680561 0.84 MMP13 (0.65) MMP13SCN9ANPSR1
SCHEMBL679956 0.83 MAPK14 (0.55) MMP13SCN9ASCN2BSCN1ASCN1B

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 PPARA 4006/4885MMP13 4543/4885SCN9A 13/4885

“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.