SCHEMBL2714847

SCHEMBL2714847

Cc1cc(C(=O)NCc2ccc(OCC(F)F)c(C)c2)cc(NC(=O)C(C)C)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
GSK3B P49841 1/20 0.47
SCN9A Q15858 1/20 0.46
KCNB1 Q14721 2/20 0.39
KCNA5 P22460 1/20 0.39
KCNH2 Q12809 1/20 0.39
CCR3 P51677 2/20 0.39
MMP13 P45452 1/20 0.39
CARM1 Q86X55 3/20 0.38
PRMT6 Q96LA8 3/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ADORA3 P0DMS8 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PTGES O14684 3/20 0.37
CHRM4 P08173 1/20 0.37
PPARG P37231 2/20 0.37
PPARD Q03181 2/20 0.37

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
SCHEMBL2718447 0.92 MAPT (0.46) MAPTGSK3BSCN9AKCNB1KCNA5
SCHEMBL2715239 0.91 SMN1; SMN2 (0.46) MAPTGSK3BSCN9AALDH1A1LMNA
SCHEMBL4550409 0.91 MAPT (0.45) MAPTGSK3BSCN9AKCNB1KCNA5
SCHEMBL2715174 0.91 SCN9A (0.51) MAPTGSK3BSCN9AKCNB1KCNA5
SCHEMBL2717551 0.91 CYP3A4 (0.39) MAPTGSK3BSCN9ACCR3MMP13
SCHEMBL2719098 0.88 SCN9A (0.51) MAPTGSK3BSCN9AKCNB1MMP13
SCHEMBL2717172 0.88 MAPT (0.61) MAPTGSK3BSCN9AKCNB1KCNA5
SCHEMBL2714698 0.88 SCN9A (0.48) MAPTGSK3BSCN9AKCNB1KCNA5
SCHEMBL2714301 0.87 PTGES (0.40) SCN9ACCR3MMP13ALDH1A1LMNA
SCHEMBL2714516 0.87 SCN9A (0.49) SCN9AKCNB1CARM1PRMT6ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP claimed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US claimed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US claimed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP claimed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 WO claimed
CN-106478497-B Arylamine derivatives as TTX-S blockers 拉夸里亚创药株式会社 2020-05-08 CN disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP disclosed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 WO disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 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-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN2B, SCN1B, SCN2A MAPT 3185/4885GSK3B 4093/4885SCN9A 31/4885

“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.