SCHEMBL2717488

SCHEMBL2717488

Cc1cc(C(=O)NCc2cccc(OCC(F)(F)F)n2)nc(NC(=O)C2CC2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
KMT2A Q03164 3/20 0.37
TSHR P16473 3/20 0.37
EPHX2 P34913 1/20 0.37
MEN1 O00255 2/20 0.37
ALDH1A1 P00352 2/20 0.37
GSK3B P49841 2/20 0.37
GSK3A P49840 1/20 0.37
JAK2 O60674 2/20 0.36
JAK1 P23458 1/20 0.36
JAK3 P52333 1/20 0.36
ACKR3 P25106 1/20 0.36
KDR P35968 2/20 0.36
ADORA2A P29274 3/20 0.35
ADORA1 P30542 2/20 0.35
KDM4E B2RXH2 1/20 0.35
USP2 O75604 1/20 0.35
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL2714351 0.86 EPHX2 (0.39) TSHREPHX2ALDH1A1GSK3BGSK3A
SCHEMBL2716755 0.84 SYK (0.44) SCN9AKMT2ATSHREPHX2ALDH1A1
SCHEMBL2714018 0.84 ALDH1A1 (0.38) TSHREPHX2ALDH1A1GSK3BGSK3A
SCHEMBL2713661 0.83 EPHX2 (0.37) KMT2ATSHREPHX2ALDH1A1GSK3B
SCHEMBL2715379 0.83 CNR2 (0.38) KMT2ATSHRMEN1ALDH1A1GSK3B
SCHEMBL2713643 0.82 EPHX2 (0.37) TSHREPHX2ALDH1A1GSK3BGSK3A
SCHEMBL2715183 0.81 GSK3B (0.40) KMT2ATSHRALDH1A1GSK3BGSK3A
SCHEMBL28946960 0.80 MMP13 (0.46) SCN5ASCN9AEPHX2KDRADORA2A
SCHEMBL2719049 0.79 RAB9A (0.48) KMT2AMEN1ALDH1A1GSK3BGSK3A
SCHEMBL2716307 0.79 GSK3B (0.57) GSK3BGSK3A

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 SCN5A 4/4885SCN9A 31/4885KMT2A 1036/4885

“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.