SCHEMBL1744111

SCHEMBL1744111

FC(F)(F)c1ccc(-c2ccc(N3CCC(CCN4CCCC4)CC3)nc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.46
DGAT1 O75907 8/20 0.46
KDM4E B2RXH2 2/20 0.46
ABL1 P00519 1/20 0.46
LMNA P02545 1/20 0.46
CYP3A4 P08684 2/20 0.45
KCNH2 Q12809 3/20 0.44
SOAT1 P35610 2/20 0.44
RPS6KB1 P23443 1/20 0.44
AKT1 P31749 1/20 0.44
CHRM4 P08173 1/20 0.43
GPR119 Q8TDV5 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
ADORA2A P29274 1/20 0.42
MCHR1 Q99705 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 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
SCHEMBL27903447 0.90 KDM4E (0.55) HTR7KDM4EABL1LMNACYP3A4
SCHEMBL12168054 0.87 DGAT1 (0.51) HTR7DGAT1KDM4ELMNAKCNH2
SCHEMBL1742748 0.83 DRD3 (0.52) HTR7DGAT1KDM4ELMNAKCNH2
SCHEMBL5623553 0.78 KDM4E (0.59) DGAT1KDM4EKCNH2SOAT1
SCHEMBL12159841 0.78 DGAT1 (0.50) HTR7DGAT1KDM4EABL1LMNA
SCHEMBL1742250 0.78 DGAT1 (0.53) HTR7DGAT1KDM4ELMNAKCNH2
SCHEMBL1742757 0.75 DRD3 (0.50) HTR7DGAT1LMNAKCNH2SOAT1
SCHEMBL1741467 0.75 DGAT1 (0.47) HTR7DGAT1KDM4ELMNAKCNH2
SCHEMBL1743040 0.75 DGAT1 (0.50) HTR7DGAT1LMNAKCNH2SOAT1
SCHEMBL13648868 0.75 HRH3 (0.56) DGAT1KDM4EABL1LMNACYP3A4

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
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-8501739-B2 Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2013-08-06 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-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
US-20090312309-A1 Novel Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2009-12-17 US 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 HTR7 73/4885DGAT1 4659/4885KDM4E 3732/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 HTR7 73/4885DGAT1 4659/4885KDM4E 3732/4885

“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.