SCHEMBL1740377

SCHEMBL1740377

c1cc2cc(-c3ccc(N4CCN(C5CC5)CC4)nn3)ccc2[nH]1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 10/20 0.61
KCNH2 Q12809 4/20 0.55
CSNK1D P48730 1/20 0.46
MAPK11 Q15759 1/20 0.46
MAPK14 Q16539 1/20 0.46
HRH3 Q9Y5N1 4/20 0.43
CHRNB2 P17787 4/20 0.43
CHRNA4 P43681 4/20 0.43
HTR3A P46098 1/20 0.43
CHRNB4 P30926 3/20 0.42
CHRNA3 P32297 3/20 0.42
ACACB O00763 3/20 0.41
ACACA Q13085 3/20 0.41

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
SCHEMBL1397905 0.78 CHRNA7 (0.71) CHRNA7KCNH2CSNK1DMAPK11MAPK14
SCHEMBL1449960 0.78 CHRNA7 (0.71) CHRNA7KCNH2CSNK1DMAPK11MAPK14
SCHEMBL5365538 0.78 CHRNA7 (0.60) CHRNA7KCNH2CSNK1DMAPK11MAPK14
SCHEMBL1977792 0.78 CHRNA7 (0.67) CHRNA7KCNH2CSNK1DMAPK11MAPK14
SCHEMBL10047166 0.78 HRH3 (0.41) KCNH2HRH3
SCHEMBL930767 0.77 CHRNA7 (0.77) CHRNA7KCNH2CHRNB2CHRNA4HTR3A
SCHEMBL18016323 0.76 CHRNA7 (1.00) CHRNA7KCNH2CSNK1DMAPK11MAPK14
SCHEMBL927767 0.76 CHRNA7 (1.00) CHRNA7KCNH2CSNK1DMAPK11MAPK14
SCHEMBL1743326 0.76 NPC1 (0.44) CHRNA7HRH3HTR3ACHRNB4CHRNA3
SCHEMBL13648900 0.75 NPC1 (0.56) CHRNA7HRH3HTR3ACHRNB4CHRNA3

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 13 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-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
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

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 CHRNA7 212/4885KCNH2 2830/4885CSNK1D 1363/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 CHRNA7 212/4885KCNH2 2830/4885CSNK1D 1363/4885

“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.