SCHEMBL1744217

SCHEMBL1744217

O=C(O)c1ccc(-c2ccc(N3CCN(C4CCCC4)CC3)nn2)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SCD O00767 6/20 0.54
HRH3 Q9Y5N1 5/20 0.47
NPC1 O15118 4/20 0.44
RAB9A P51151 3/20 0.44
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 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
SCHEMBL1744201 0.86 HRH3 (0.56) HRH3POLBMEN1KMT2A
SCHEMBL3043622 0.84 HRH3 (0.48) SCDHRH3NPC1RAB9ATP53
SCHEMBL4496153 0.82 HRH3 (0.45) SCDHRH3NPC1RAB9ATP53
SCHEMBL3967998 0.82 MAPT (0.51) SCDHRH3MAPTMEN1KMT2A
SCHEMBL1742364 0.81 HRH3 (0.52) SCDHRH3
SCHEMBL1743448 0.81 HRH3 (0.46) SCDHRH3NPC1RAB9ATP53
SCHEMBL1742433 0.80 SCD (0.52) SCDNPC1RAB9ATP53MAPT
SCHEMBL3971458 0.80 MAPT (0.47) HRH3TP53MAPTPOLB
SCHEMBL13648802 0.79 SCD (0.54) SCDHRH3NPC1RAB9AMAPT
SCHEMBL13648900 0.79 NPC1 (0.56) HRH3NPC1RAB9ATP53MAPT

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 SCD 4800/4885HRH3 1/4885NPC1 2646/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 SCD 4800/4885HRH3 1/4885NPC1 2646/4885

“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.