SCHEMBL2715038

SCHEMBL2715038

CCC(=O)Nc1cc(C(=O)NCc2ccc(OCC(F)(F)F)c(C)c2)cc(C)n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 3/20 0.41
CACNA1G O43497 1/20 0.41
CYP3A4 P08684 1/20 0.41
CACNA1C Q13936 1/20 0.41
CACNA1I Q9P0X4 1/20 0.41
ADORA3 P0DMS8 4/20 0.40
ADORA1 P30542 3/20 0.40
PPARG P37231 5/20 0.40
PPARD Q03181 5/20 0.40
PPARA Q07869 5/20 0.40
SCN9A Q15858 2/20 0.39
NPC1 O15118 2/20 0.38
TP53 P04637 2/20 0.38
RAB9A P51151 2/20 0.38
HSD17B10 Q99714 1/20 0.38
PTGES O14684 1/20 0.38
ADORA2A P29274 1/20 0.37
LMNA P02545 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 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
SCHEMBL2715367 0.91 RIPK1 (0.44) CACNA1HCACNA1GCYP3A4CACNA1CCACNA1I
SCHEMBL2716422 0.89 GSK3B (0.47) ADORA3PPARGPPARDPPARASCN9A
SCHEMBL2717500 0.88 PPARG (0.40) CACNA1HCACNA1GCYP3A4CACNA1CCACNA1I
SCHEMBL2719098 0.88 SCN9A (0.51) CACNA1HCACNA1GCYP3A4CACNA1CCACNA1I
SCHEMBL2717299 0.88 GSK3B (0.47) CACNA1HCACNA1GCYP3A4CACNA1CCACNA1I
SCHEMBL2717677 0.85 PTGES (0.45) CACNA1HCACNA1GCACNA1ISCN9APTGES
SCHEMBL2715783 0.85 SCN9A (0.44) ADORA3ADORA1SCN9ANPC1TP53
SCHEMBL2715667 0.85 EPHX2 (0.40) ADORA3ADORA1SCN9ANPC1TP53
SCHEMBL2715325 0.84 ALDH1A1 (0.44) CYP3A4ADORA3ADORA1PPARGSCN9A
SCHEMBL2718582 0.81 LMNA (0.46) ADORA3LMNAALDH1A1

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 15 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
CN-103249721-A Arylamine Derivatives as TTX-S Blockers RAQUALIA PHARMA INC 2013-08-14 CN 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
CN-103249721-A Arylamine Derivatives as TTX-S Blockers RAQUALIA PHARMA INC 2013-08-14 CN 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 CACNA1H 19/4885CACNA1G 13/4885CYP3A4 2785/4885

“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.