SCHEMBL4550384

SCHEMBL4550384

CC(N)c1ccc(OCCC(F)(F)F)nc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 12/20 0.41
ACACB O00763 2/20 0.39
MCHR1 Q99705 1/20 0.37
SCN5A Q14524 4/20 0.36
SCN9A Q15858 4/20 0.36
KCNH2 Q12809 3/20 0.36
PDE2A O00408 1/20 0.36

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
Hydrochloric Acid SCHEMBL2714794 0.98 EPHX2 (0.41) EPHX2ACACBMCHR1SCN5ASCN9A
SCHEMBL11914066 0.88 EPHX2 (0.43) EPHX2ACACBMCHR1SCN5ASCN9A
SCHEMBL10253315 0.84 L3MBTL1 (0.49) EPHX2SCN9AKCNH2PDE2A
SCHEMBL10253316 0.84 L3MBTL1 (0.49) EPHX2SCN9AKCNH2PDE2A
SCHEMBL14480094 0.84 L3MBTL1 (0.49) EPHX2SCN9AKCNH2PDE2A
SCHEMBL2691179 0.84 L3MBTL1 (0.49) EPHX2SCN9AKCNH2PDE2A
SCHEMBL16233079 0.84 SCN9A (0.39) EPHX2SCN5ASCN9AKCNH2PDE2A
Hydrochloric Acid SCHEMBL2714923 0.83 L3MBTL1 (0.48) EPHX2SCN9AKCNH2PDE2A
Hydrochloric Acid SCHEMBL2713983 0.83 SCN9A (0.38) EPHX2SCN5ASCN9AKCNH2PDE2A
SCHEMBL2690752 0.83 APP (0.39) ACACBPDE2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 EPHX2 2460/4885ACACB 1601/4885MCHR1 2909/4885

“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.