SCHEMBL2743530

SCHEMBL2743530

O=C(c1ccc(C(=O)N2CCCC2CN2CCCC2)cc1)C1CC1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.58
KCNH2 Q12809 1/20 0.51
MET P08581 3/20 0.48
IKBKB O14920 2/20 0.48
MAOB P27338 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
SCHEMBL2743533 1.00 HRH3 (0.58) HRH3KCNH2METIKBKBMAOB
Hydrochloric Acid SCHEMBL2743472 0.99 HRH3 (0.57) HRH3KCNH2METIKBKBMAOB
Hydrochloric Acid SCHEMBL2743471 0.99 HRH3 (0.57) HRH3KCNH2METIKBKBMAOB
SCHEMBL12392702 0.96 HRH3 (0.61) HRH3METIKBKB
SCHEMBL12392929 0.96 HRH3 (0.61) HRH3METIKBKB
SCHEMBL1794728 0.86 HRH3 (0.61) HRH3KCNH2METIKBKB
SCHEMBL1794727 0.86 HRH3 (0.61) HRH3KCNH2METIKBKB
SCHEMBL2743746 0.85 HRH3 (0.61) HRH3KCNH2METIKBKB
SCHEMBL3565339 0.85 HRH3 (0.64) HRH3KCNH2MET
SCHEMBL1835474 0.85 HRH3 (0.60) HRH3KCNH2METIKBKB

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1868991-B1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2014-07-30 EP claimed
US-8178528-B2 Histamine H3 receptor agents, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2012-05-15 US claimed
US-20100160406-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY 2010-06-24 US claimed
EP-1868991-B1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2014-07-30 EP disclosed
US-8178528-B2 Histamine H3 receptor agents, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2012-05-15 US disclosed
US-8178528-B2 Histamine H3 receptor agents, preparation and therapeutic uses ELI LILLY AND COMPANY (US) 2012-05-15 US disclosed
US-20100160406-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY 2010-06-24 US disclosed
US-20100160406-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY 2010-06-24 US disclosed
US-7195751-B2 Compositions and kits pertaining to analyte determination APPLERA CORPORATION (US) 2007-03-27 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 (1 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-20100160406-A1 HISTAMINE H3 RECEPTOR AGENTS, PREPARATION AND THERAPEUTIC USES HRH3, HRH4, HCRTR1 HRH3 1/4885KCNH2 1678/4885MET 734/4885

“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.