SCHEMBL1744575

SCHEMBL1744575

FC(F)(F)c1ccc(-c2ccc(N3CCN(C4CCCCC4)CC3)nc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.52
HRH3 Q9Y5N1 3/20 0.50
KDM2B Q8NHM5 1/20 0.49
KDM4E B2RXH2 3/20 0.48
ABL1 P00519 1/20 0.48
LMNA P02545 1/20 0.48
CYP3A4 P08684 2/20 0.47
SOAT1 P35610 2/20 0.47
KCNH2 Q12809 2/20 0.47
MGLL Q99685 1/20 0.45
SMO Q99835 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPT P10636 2/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL13648868 0.94 HRH3 (0.56) DGAT1HRH3KDM2BKDM4EABL1
Hydrochloric Acid SCHEMBL3976876 0.92 HRH3 (0.55) DGAT1HRH3KDM2BKDM4EABL1
SCHEMBL27728031 0.91 KDM4E (0.56) HRH3KDM4EABL1LMNACYP3A4
SCHEMBL3967944 0.90 KDM4E (0.58) HRH3KDM4EABL1LMNACYP3A4
SCHEMBL1742737 0.88 DGAT1 (0.53) DGAT1HRH3KDM4EABL1LMNA
SCHEMBL5623553 0.84 KDM4E (0.59) DGAT1KDM4ESOAT1KCNH2MGLL
Hydrochloric Acid SCHEMBL27620712 0.83 HRH3 (0.61) HRH3KDM4EABL1LMNACYP3A4
SCHEMBL3977911 0.82 HRH3 (0.47) DGAT1HRH3
SCHEMBL13648802 0.80 SCD (0.54) HRH3KDM2BLMNAMAPTSMN1; SMN2
SCHEMBL1743197 0.79 HRH3 (0.46) DGAT1HRH3KDM2B

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
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
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
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 DGAT1 4659/4885HRH3 1/4885KDM2B 4121/4885
US-20090312309-A1 Novel Medicaments HRH3, HRH4, HRH1 DGAT1 4659/4885HRH3 1/4885KDM2B 4121/4885

“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.