SCHEMBL1744634

SCHEMBL1744634

O=C(O)c1ccc(-c2ccc(N3CCN(CC4CC4)CC3)nc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RET P07949 3/20 0.45
KDM2B Q8NHM5 4/20 0.43
MGLL Q99685 1/20 0.43
SCD O00767 1/20 0.42
HTR1A P08908 1/20 0.42
DRD4 P21917 1/20 0.42
HTR2A P28223 1/20 0.42
SLC6A4 P31645 1/20 0.42
DRD3 P35462 1/20 0.42
SMO Q99835 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
WDR5 P61964 1/20 0.41
MAP4K4 O95819 1/20 0.41
EZH2 Q15910 1/20 0.41
SLC6A7 Q99884 1/20 0.40

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
SCHEMBL1742290 0.85 HPGD (0.52) MGLLEGLN1SLC6A7
SCHEMBL23594261 0.82 KDM2B (0.47) RETKDM2BSMO
SCHEMBL1742433 0.82 SCD (0.52) KDM2BSCD
SCHEMBL1743100 0.81 RET (0.43) RETHTR1ADRD4HTR2ASLC6A4
SCHEMBL1743224 0.81 HRH3 (0.50) MGLLSCDEGLN1SLC6A7
SCHEMBL1742364 0.79 HRH3 (0.52) RETMGLLSCDEGLN1
SCHEMBL1743848 0.79 RET (0.52) RET
SCHEMBL1742588 0.77 HRH3 (0.50) RETHTR1ADRD4HTR2ASLC6A4
SCHEMBL1743345 0.76 HRH3 (0.57) EGLN1
SCHEMBL23875271 0.74 HPGDS (0.46) HTR1ADRD4HTR2ASLC6A4DRD3

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 10 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
CN-103110635-A Histamine H3 receptor antagonist NOVO NORDISK AS 2013-05-22 CN 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
CN-101218206-A Histamine H3 receptor antagonists NOVO NORDISK AS (DK) 2008-07-09 CN 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 RET 453/4885KDM2B 4121/4885MGLL 2383/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 RET 453/4885KDM2B 4121/4885MGLL 2383/4885

“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.