SCHEMBL2715032

SCHEMBL2715032

CC(C)C(=O)Nc1cc(C(=O)NC(C)c2cc(Cl)cc(OC(F)(F)F)c2)ccn1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 9/20 0.48
MAPT P10636 8/20 0.48
SCN9A Q15858 1/20 0.47
PTGER4 P35408 2/20 0.41
TYK2 P29597 1/20 0.41
GSK3A P49840 1/20 0.40
MAPK1 P28482 3/20 0.40
ACACB O00763 1/20 0.40
PDE2A O00408 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
KMT2A Q03164 1/20 0.40
NTRK1 P04629 1/20 0.40
PTGDR Q13258 1/20 0.39
FDPS P14324 1/20 0.39

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
SCHEMBL18266729 0.94 MAPT (0.47) GSK3BMAPTSCN9ATYK2MAPK1
SCHEMBL2714555 0.91 ACACB (0.48) GSK3BPTGER4GSK3AMAPK1ACACB
SCHEMBL2718235 0.87 PDE2A (0.52) GSK3BMAPTSCN9AGSK3AMAPK1
SCHEMBL2718234 0.87 PDE2A (0.52) GSK3BMAPTSCN9AGSK3AMAPK1
SCHEMBL2715785 0.87 MAPK1 (0.49) GSK3BMAPTGSK3AMAPK1MEN1
SCHEMBL4550400 0.86 MAPT (0.47) GSK3BMAPTSCN9AMAPK1ACACB
SCHEMBL2714636 0.85 SCN9A (0.47) SCN9APTGER4MAPK1PDE2APTGDR
SCHEMBL18266580 0.85 ACACB (0.47) GSK3BMAPTSCN9AMAPK1ACACB
SCHEMBL15349989 0.81 TRPV1 (0.49) GSK3BMAPTMAPK1PDE2AMEN1
SCHEMBL2715599 0.80 SCN9A (0.53) GSK3BMAPTSCN9ATYK2MAPK1

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 11 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
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

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 GSK3B 4093/4885MAPT 3185/4885SCN9A 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.