SCHEMBL4591287

SCHEMBL4591287

FC(F)(F)Oc1ccc(-c2cccc(CCl)n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN5A Q14524 4/20 0.48
SCN10A Q9Y5Y9 2/20 0.47
SUCNR1 Q9BXA5 1/20 0.46
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
RAB9A P51151 1/20 0.43
EPHB4 P54760 1/20 0.43
TEK Q02763 1/20 0.43
ABL1 P00519 1/20 0.43
ACP1 P24666 1/20 0.41
ALOX5 P09917 1/20 0.40
SCN2A Q99250 1/20 0.39
ADORA2A P29274 1/20 0.39
DHODH Q02127 1/20 0.39
CYP1A2 P05177 2/20 0.39
TRPV3 Q8NET8 1/20 0.39
ADORA3 P0DMS8 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
SCHEMBL4590801 0.85 SUCNR1 (0.48) SCN5ASCN10ASUCNR1KDM4ENPC1
SCHEMBL23176310 0.85 SCN5A (0.48) SCN5ASCN10ASUCNR1KDM4ENPC1
SCHEMBL27955763 0.80 SCN5A (0.51) SCN5ASCN10ASUCNR1KDM4ENPC1
SCHEMBL4592336 0.80 TRPV3 (0.54) TRPV3SCN9A
SCHEMBL13680824 0.79 SUCNR1 (0.44) SCN5ASCN10ASUCNR1KDM4ENPC1
SCHEMBL6484177 0.77 SCN9A (0.43) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL22421794 0.76 ASIC3 (0.55) SCN5ASCN10ASUCNR1KDM4ENPC1
SCHEMBL10203331 0.76 SCN10A (0.53) SCN5ASCN10ASUCNR1KDM4ENPC1
SCHEMBL4592241 0.75 GFER (0.47) KDM4ENPC1ALDH1A1MAPTRAB9A
SCHEMBL5376937 0.75 MEN1 (0.60) KDM4EALDH1A1MAPTRAB9AADORA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7429605-B2 Phenylpyridine derivatives HOFFMANN-LA ROCHE INC. (US) 2008-09-30 US disclosed
CN-101213186-A Phenylpyridine derivatives, their manufacture and use as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2008-07-02 CN disclosed
EP-1912969-A1 PHENYLPYRIDINE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-04-23 EP disclosed
WO-2007017169-A1 PHENYLPYRIDINE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2007-02-15 WO disclosed
US-20070032530-A1 Phenylpyridine derivatives HOFFMANN-LA ROCHE INC. 2007-02-08 US 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-20070032530-A1 Phenylpyridine derivatives CYP3A5, QDPR, DPYD SCN5A 37/4885SCN10A 1868/4885SUCNR1 748/4885

“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.