SCHEMBL1742853

SCHEMBL1742853

FC(F)(F)Oc1ccc(-c2ccc(Cl)nc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.54
PIK3CD O00329 1/20 0.47
SCN5A Q14524 9/20 0.47
CA12 O43570 1/20 0.46
CA9 Q16790 1/20 0.46
CYP2A6 P11509 1/20 0.44
KCNH2 Q12809 2/20 0.43
SCN1A P35498 2/20 0.43
SCN2A Q99250 2/20 0.43
SCN10A Q9Y5Y9 2/20 0.43
SCN9A Q15858 1/20 0.43
SCN8A Q9UQD0 1/20 0.43
TEK Q02763 1/20 0.43
AKR1C2 P52895 1/20 0.42
AKR1C1 Q04828 1/20 0.42
KIF11 P52732 1/20 0.41
NISCH Q9Y2I1 1/20 0.41

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
SCHEMBL29411244 0.85 SLC7A5 (0.48) CHRM5
SCHEMBL2302955 0.85 SLC7A5 (0.48) CHRM5
SCHEMBL1230049 0.84 SCN5A (0.48) SCN5ACA12CA9KCNH2SCN1A
SCHEMBL17157363 0.80 SCN5A (0.48) SCN5ACA12CA9KCNH2SCN1A
SCHEMBL1227164 0.80 CHRM5 (0.52) CHRM5SCN5ACA12CA9CYP2A6
SCHEMBL20203802 0.79 CYP1A2 (0.48) SCN5AKCNH2SCN1ASCN2ASCN10A
SCHEMBL3265605 0.79 MEN1 (0.47) SCN5ACA12CA9KCNH2SCN1A
SCHEMBL18654126 0.79 LTA4H (0.56) PIK3CDSCN5ACA12CA9KCNH2
SCHEMBL14358183 0.77 NPC1 (0.55) CHRM5
SCHEMBL16215338 0.76 GABBR2 (0.49) SCN5ACA12CA9KCNH2SCN1A

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
US-8846677-B2 Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2014-09-30 US disclosed
US-8501739-B2 Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2013-08-06 US disclosed
US-20120232078-A1 Novel Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2012-09-13 US disclosed
EP-2386554-A1 Compounds active at the histamine H3 receptor High Point Pharmaceuticals, LLC (US) 2011-11-16 EP disclosed
EP-2233470-A1 Histamine H3 receptor antagonists High Point Pharmaceuticals, LLC (US) 2010-09-29 EP disclosed
US-20090312309-A1 Novel Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2009-12-17 US disclosed
EP-1902028-A2 HISTAMINE H3 RECEPTOR ANTAGONISTS Novo Nordisk A/S (DK) 2008-03-26 EP disclosed
WO-2007003604-A2 HISTS1MINE H3 RECEPTOR ANTAGONISTS NOVO NORDISK A/S (DK) 2007-01-11 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 (2 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-20120232078-A1 Novel Medicaments HRH3, HRH4, HRH1 CHRM5 65/4885PIK3CD 3134/4885SCN5A 1991/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 CHRM5 65/4885PIK3CD 3134/4885SCN5A 1991/4885

“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.