SCHEMBL1744043

SCHEMBL1744043

CC(C)N1CCN(c2ccc(-c3ccc(C4CN(C=O)CCO4)cc3)cn2)CC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.39
HRH3 Q9Y5N1 10/20 0.39
TLR9 Q9NR96 3/20 0.38
TLR8 Q9NR97 3/20 0.38
TLR7 Q9NYK1 2/20 0.38
ACVR1 Q04771 1/20 0.37
ACACB O00763 1/20 0.36
ERN1 O75460 1/20 0.35

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
SCHEMBL1744072 0.90 CHRM2 (0.40) HDAC4HRH3TLR9TLR8TLR7
SCHEMBL1743085 0.85 ACACB (0.37) HDAC4HRH3ACACB
SCHEMBL1744076 0.83 HRH3 (0.38) HRH3ACVR1
SCHEMBL1743145 0.74 TLR9 (0.46) HRH3TLR9TLR8TLR7ACVR1
SCHEMBL1743020 0.73 HDAC4 (0.40) HDAC4HRH3TLR9TLR8TLR7
SCHEMBL3062019 0.73 HRH3 (0.34) HRH3ACVR1
SCHEMBL27921240 0.72 TLR9 (0.44) HRH3TLR9TLR8TLR7ACVR1
SCHEMBL3468650 0.72 OGA (0.40)
SCHEMBL5819684 0.72 TLR9 (0.44) HDAC4HRH3TLR9TLR8TLR7
SCHEMBL1744089 0.70 CNR2 (0.49) HRH3TLR9TLR8TLR7ACVR1

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 claimed
EP-2386554-A1 Compounds active at the histamine H3 receptor High Point Pharmaceuticals, LLC (US) 2011-11-16 EP claimed
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-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
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 HDAC4 306/4885HRH3 1/4885TLR9 1791/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 HDAC4 306/4885HRH3 1/4885TLR9 1791/4885

“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.