SCHEMBL2715554

SCHEMBL2715554

CC(=O)Nc1cc(C(=O)NCc2cnc(OCC(F)F)c(C)c2)cc(C)n1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.42
CCR3 P51677 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HTT P42858 1/20 0.34
PRKD3 O94806 1/20 0.34
MAPK8 P45983 1/20 0.34
MAPT P10636 1/20 0.34
GSK3B P49841 1/20 0.34
KLKB1 P03952 1/20 0.34
MAP4K1 Q92918 1/20 0.34
RIPK1 Q13546 2/20 0.33
PTGES O14684 1/20 0.33
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
CHRM4 P08173 1/20 0.33
POLB P06746 1/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CHRNB2 P17787 1/20 0.32

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
SCHEMBL2718745 0.91 SCN9A (0.52) SCN9ACCR3HTTPRKD3MAPK8
SCHEMBL2716501 0.91 SCN9A (0.44) SCN9AALDH1A1HTTPRKD3MAPK8
SCHEMBL2715702 0.91 SCN9A (0.41) SCN9ACCR3ALDH1A1MAPTGSK3B
SCHEMBL2718458 0.91 SCN9A (0.50) SCN9ACCR3ALDH1A1HTTPRKD3
SCHEMBL2713603 0.89 CCR3 (0.41) SCN9ACCR3MAPTGSK3BMAP4K1
SCHEMBL2714871 0.87 SCN9A (0.39) SCN9ACCR3GSK3BRIPK1
SCHEMBL2713499 0.87 SCN9A (0.38) SCN9ACCR3ALDH1A1MAPTGSK3B
SCHEMBL2717596 0.87 SCN9A (0.43) SCN9AALDH1A1HTTMAPTKLKB1
SCHEMBL2714712 0.87 SCN9A (0.40) SCN9ACCR3MAPTGSK3B
SCHEMBL2712842 0.86 SCN9A (0.45) SCN9ARIPK1PTGES

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 SCN9A 31/4885CCR3 4485/4885ALDH1A1 1358/4885

“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.