SCHEMBL1743223

SCHEMBL1743223

CC(C)N1CCN(c2ccc(-c3cccc(C(=O)O)c3)cn2)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.50
OGA O60502 1/20 0.48
ACVR1 Q04771 1/20 0.47
TLR9 Q9NR96 3/20 0.46
TLR8 Q9NR97 3/20 0.46
TLR7 Q9NYK1 2/20 0.46
EGLN1 Q9GZT9 2/20 0.46
LDHA P00338 1/20 0.45
LDHB P07195 1/20 0.45
KMO O15229 1/20 0.45
MGLL Q99685 2/20 0.44
CNR2 P34972 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC2 Q92769 1/20 0.43
AOC3 Q16853 1/20 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
SCHEMBL1744152 0.88 HRH3 (0.52) HRH3OGAACVR1TLR9TLR8
SCHEMBL1743345 0.87 HRH3 (0.57) HRH3OGATLR9TLR8TLR7
SCHEMBL1743126 0.86 MGLL (0.50) HRH3EGLN1MGLL
SCHEMBL12159805 0.86 TLR9 (0.43) HRH3ACVR1TLR9TLR8TLR7
SCHEMBL1744070 0.84 HPGD (0.55) HRH3MGLLCNR2AOC3
SCHEMBL1742838 0.83 AKR1C3 (0.46) HRH3OGATLR9TLR8TLR7
SCHEMBL1744319 0.82 LDHA (0.46) LDHALDHBKMOAOC3
SCHEMBL1742215 0.82 TLR9 (0.53) HRH3ACVR1TLR9TLR8TLR7
SCHEMBL1744273 0.81 ACVR1 (0.46) HRH3ACVR1EGLN1KMOMGLL
SCHEMBL30109094 0.81 HRH3 (0.69) HRH3OGA

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 HRH3 1/4885OGA 3751/4885ACVR1 4064/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 HRH3 1/4885OGA 3751/4885ACVR1 4064/4885

“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.