SCHEMBL1743040

SCHEMBL1743040

CN(C)CCN1CCN(c2ccc(-c3ccc(C(F)(F)F)cc3)cn2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.50
SOAT1 P35610 2/20 0.50
KCNH2 Q12809 2/20 0.50
RET P07949 1/20 0.46
DRD4 P21917 2/20 0.46
GRM2 Q14416 1/20 0.46
DRD3 P35462 2/20 0.46
TLR7 Q9NYK1 1/20 0.46
HTR1A P08908 1/20 0.46
HTR2A P28223 1/20 0.46
SLC6A4 P31645 1/20 0.46
DRD2 P14416 1/20 0.45
DRD1 P21728 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
MGLL Q99685 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.43
SMO Q99835 1/20 0.43
LMNA P02545 1/20 0.43
SRPK1 Q96SB4 1/20 0.42

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
SCHEMBL13136612 0.91 RET (0.47) DGAT1SOAT1KCNH2RETDRD4
SCHEMBL27728208 0.90 DRD4 (0.55) DRD4GRM2TLR7SMN1; SMN2HPGD
SCHEMBL1744121 0.88 DGAT1 (0.48) DGAT1SOAT1KCNH2DRD4GRM2
SCHEMBL1742250 0.86 DGAT1 (0.53) DGAT1SOAT1KCNH2RETDRD4
SCHEMBL13136653 0.85 SLC6A4 (0.46) DGAT1SOAT1KCNH2RETDRD4
SCHEMBL12168054 0.85 DGAT1 (0.51) DGAT1SOAT1KCNH2DRD4GRM2
SCHEMBL12159841 0.84 DGAT1 (0.50) DGAT1SOAT1KCNH2RETDRD4
SCHEMBL1742757 0.83 DRD3 (0.50) DGAT1SOAT1KCNH2RETDRD4
SCHEMBL1742748 0.82 DRD3 (0.52) DGAT1SOAT1KCNH2DRD4GRM2
SCHEMBL13177715 0.81 DGAT1 (0.48) DGAT1SOAT1KCNH2DRD4GRM2

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 17 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-8846677-B2 Medicaments HIGH POINT PHARMACEUTICALS, LLC (US) 2014-09-30 US disclosed
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
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
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 DGAT1 4659/4885SOAT1 2759/4885KCNH2 2830/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 DGAT1 4659/4885SOAT1 2759/4885KCNH2 2830/4885

“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.