SCHEMBL1742822

SCHEMBL1742822

O=C(c1ccc(-c2ccc(N3CCN(C4CCCC4)CC3)nc2)cc1)N1CCCCC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL3 Q96JM7 9/20 0.56
L3MBTL1 Q9Y468 8/20 0.56
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 3/20 0.54
POLB P06746 2/20 0.54
HPGD P15428 2/20 0.54
ALOX15 P16050 1/20 0.54
HSD17B10 Q99714 1/20 0.54
MBTD1 Q05BQ5 5/20 0.53
TP53BP1 Q12888 1/20 0.51
L3MBTL4 Q8NA19 1/20 0.51
HRH3 Q9Y5N1 4/20 0.51
MAPK1 P28482 1/20 0.48
SLC6A7 Q99884 1/20 0.48

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
Hydrochloric Acid SCHEMBL4010524 0.99 L3MBTL3 (0.55) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
SCHEMBL1744106 0.97 ALDH1A1 (0.55) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
SCHEMBL3975118 0.91 ALDH1A1 (0.65) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
SCHEMBL1744074 0.90 ALDH1A1 (0.60) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
SCHEMBL1743084 0.90 L3MBTL1 (0.56) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
Hydrochloric Acid SCHEMBL3972227 0.90 ALDH1A1 (0.64) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
SCHEMBL13648890 0.87 ALDH1A1 (0.67) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
SCHEMBL22750959 0.87 HPGD (0.65) L3MBTL1KDM4EALDH1A1POLBHPGD
Hydrochloric Acid SCHEMBL3977312 0.86 ALDH1A1 (0.65) L3MBTL3L3MBTL1KDM4EALDH1A1POLB
SCHEMBL1742364 0.86 HRH3 (0.52) L3MBTL3L3MBTL1KDM4EHRH3

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 19 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-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
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
US-7494994-B2 Phenylpyridylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2009-02-24 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
US-20060258670-A1 New phenylpyridylpiperazine compounds LES LABORATOIRES SERVIER (FR) 2006-11-16 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 (3 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-20060258670-A1 New phenylpyridylpiperazine compounds HRH4, HRH3, HRH2 L3MBTL3 2839/4885L3MBTL1 4148/4885KDM4E 2057/4885
US-20120232078-A1 Novel Medicaments HRH3, HRH4, HRH1 L3MBTL3 4193/4885L3MBTL1 4157/4885KDM4E 3732/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 L3MBTL3 4193/4885L3MBTL1 4157/4885KDM4E 3732/4885

“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.