SCHEMBL2714130

SCHEMBL2714130

FC(F)(F)CCc1ccc(CCl)cn1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.34
HTR2A P28223 2/20 0.33
HTR2C P28335 1/20 0.33
KCNH2 Q12809 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
DAO P14920 1/20 0.30

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
SCHEMBL4550766 0.82 LOXL2 (0.36) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL2717171 0.82 HRH3 (0.34) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL8015449 0.81 ALDH1A1 (0.31)
Hydrochloric Acid SCHEMBL2713568 0.81 LOXL2 (0.38) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL7992265 0.79 HRH3 (0.37) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL18924318 0.79 ESR1 (0.36) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL7996165 0.79 HRH3 (0.39) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL18924439 0.77 HRH3 (0.34) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL4135195 0.76 HRH3 (0.34) HRH3HTR2AHTR2CKCNH2CYP1A2
SCHEMBL23970114 0.76 HRH3 (0.44) HRH3HTR2AHTR2CKCNH2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
CN-103249721-B Arylamine Derivatives as TTX-S Blockers 拉夸里亚创药株式会社 2016-10-12 CN 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
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

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 HRH3 1015/4885HTR2A 523/4885HTR2C 1121/4885

“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.