SCHEMBL9953292

SCHEMBL9953292

COC(=O)[C@H](C)Nc1cc(Cl)cc(Cl)n1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 7/20 0.45
▸ FPR2 P25090 6/20 0.42
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ RECQL P46063 1/20 0.36
▸ MAPT P10636 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ CA14 Q9ULX7 1/20 0.34
▸ GAA P10253 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34

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
SCHEMBL9953290 1.00 SCN9A (0.45) SCN9AFPR2MEN1KMT2ALMNA
SCHEMBL12127970 0.77 TRPM8 (0.39) SCN9AMEN1KMT2ARECQLMAPT
SCHEMBL14744428 0.76 LMNA (0.53) SCN9AFPR2LMNA
SCHEMBL14743282 0.76 FPR2 (0.55) SCN9AFPR2LMNA
SCHEMBL14743286 0.76 LMNA (0.53) SCN9AFPR2LMNA
SCHEMBL14743280 0.76 FPR2 (0.55) SCN9AFPR2LMNA
SCHEMBL11292581 0.74 MEN1 (0.45) SCN9AFPR2MEN1KMT2ALMNA
SCHEMBL9953216 0.74 SCN9A (0.84) SCN9AFPR2
SCHEMBL9953218 0.74 SCN9A (0.84) SCN9AFPR2
SCHEMBL14743671 0.73 SCN9A (0.45) SCN9AFPR2LMNA

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9656959-B2 Substituted pyridines as sodium channel blockers PURDUE PHARMA L.P. (US) 2017-05-23 — — US disclosed
US-9656959-B2 Substituted pyridines as sodium channel blockers PURDUE PHARMA L.P. (US) 2017-05-23 — — US disclosed
US-9656959-B2 Substituted pyridines as sodium channel blockers PURDUE PHARMA L.P. (US) 2017-05-23 — — US disclosed
EP-2655330-B1 SUBSTITUTED PYRIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA LP (US) 2016-02-10 — — EP disclosed
EP-2655330-B1 SUBSTITUTED PYRIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA LP (US) 2016-02-10 — — EP disclosed
US-20140005212-A1 Substituted Pyridines as Sodium Channel Blockers PURDUE PHARMA L.P. (US) 2014-01-02 — — US disclosed
EP-2655330-A1 SUBSTITUTED PYRIDINES AS SODIUM CHANNEL BLOCKERS Purdue Pharma LP (US) 2013-10-30 — — EP disclosed
WO-2012085650-A1 SUBSTITUTED PYRIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2012-06-28 — — WO disclosed
WO-2012085650-A1 SUBSTITUTED PYRIDINES AS SODIUM CHANNEL BLOCKERS PURDUE PHARMA L.P. (US) 2012-06-28 — — WO 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-20140005212-A1 Substituted Pyridines as Sodium Channel Blockers SCN1B, CACNA1A, SCN1A SCN9A 97/4885FPR2 1488/4885MEN1 1832/4885

“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.

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