SCHEMBL1742748

SCHEMBL1742748

FC(F)(F)c1ccc(-c2ccc(N3CCN(CCCN4CCCCC4)CC3)nc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 3/20 0.52
DRD4 P21917 2/20 0.52
HTR1A P08908 1/20 0.52
HTR2A P28223 1/20 0.52
SLC6A4 P31645 1/20 0.52
DRD2 P14416 2/20 0.51
DRD1 P21728 1/20 0.51
KCNH2 Q12809 3/20 0.48
DGAT1 O75907 2/20 0.48
SOAT1 P35610 2/20 0.48
HTR7 P34969 1/20 0.48
CASP1 P29466 1/20 0.46
CASP4 P49662 1/20 0.46
CASP5 P51878 1/20 0.46
MGLL Q99685 1/20 0.45
ADRA1A P35348 1/20 0.45
GRM2 Q14416 1/20 0.44
KDM4E B2RXH2 2/20 0.44
CHKA P35790 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.43

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
SCHEMBL12168054 0.94 DGAT1 (0.51) DRD3DRD4HTR1AHTR2ASLC6A4
SCHEMBL12159841 0.85 DGAT1 (0.50) DRD3DRD4HTR1AHTR2ASLC6A4
SCHEMBL1742250 0.85 DGAT1 (0.53) DRD3DRD4HTR1AHTR2ASLC6A4
SCHEMBL1744111 0.83 HTR7 (0.46) KCNH2DGAT1SOAT1HTR7KDM4E
SCHEMBL5623553 0.83 KDM4E (0.59) KCNH2DGAT1SOAT1MGLLKDM4E
SCHEMBL1742757 0.82 DRD3 (0.50) DRD3DRD4HTR1AHTR2ASLC6A4
SCHEMBL1743040 0.82 DGAT1 (0.50) DRD3DRD4HTR1AHTR2ASLC6A4
SCHEMBL1741467 0.82 DGAT1 (0.47) DRD3DRD4HTR1AHTR2ASLC6A4
SCHEMBL13177715 0.80 DGAT1 (0.48) DRD3DRD4HTR1AHTR2ASLC6A4
SCHEMBL1744121 0.80 DGAT1 (0.48) DRD3DRD4HTR1AHTR2ASLC6A4

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 18 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
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 DRD3 1442/4885DRD4 2377/4885HTR1A 114/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 DRD3 1442/4885DRD4 2377/4885HTR1A 114/4885

“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.