SCHEMBL680757

SCHEMBL680757

COc1cc(C)ccc1Oc1ccc(C(=O)NS(C)(=O)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 7/20 0.53
GAA P10253 1/20 0.47
TTR P02766 1/20 0.47
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
LMNA P02545 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
AHR P35869 1/20 0.46
ALDH1A1 P00352 1/20 0.45
TP53 P04637 1/20 0.45
MMP13 P45452 1/20 0.44
MRGPRX1 Q96LB2 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MCL1 Q07820 1/20 0.43

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
SCHEMBL678507 0.95 SCN9A (0.53) SCN9AGAAMAPTMAPK1LMNA
SCHEMBL678837 0.87 SCN9A (0.59) SCN9AMMP13
SCHEMBL678839 0.87 PPARA (0.47) SCN9AMMP13MRGPRX1
SCHEMBL680062 0.87 MMP13 (0.47) SCN9AMAPTMAPK1MMP13
SCHEMBL678799 0.86 SCN9A (0.56) SCN9ATTRMEN1KMT2A
SCHEMBL680642 0.85 SCN9A (0.50) SCN9AMAPTMAPK1MMP13MRGPRX1
SCHEMBL365526 0.85 SCN9A (0.54) SCN9AMMP13
SCHEMBL679939 0.84 MEN1 (0.60) SCN9AGAATTRMAPK1LMNA
SCHEMBL679029 0.82 SCN9A (0.56) SCN9A
SCHEMBL680358 0.82 SCN9A (0.64) SCN9AGAAMAPTLMNAMEN1

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 13/4885GAA 3927/4885TTR 2543/4885

“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.