SCHEMBL1506311

SCHEMBL1506311

CC1CCCN1C[C@H]1C[C@@H](c2ccc(-c3cncnc3)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 17/20 0.42
KCNH2 Q12809 5/20 0.42
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL1506313 1.00 HRH3 (0.42) HRH3KCNH2ALDH1A1
SCHEMBL1506288 0.84 HRH3 (0.46) HRH3KCNH2
SCHEMBL1506290 0.84 HRH3 (0.46) HRH3KCNH2
SCHEMBL1498079 0.83 HRH3 (0.45) HRH3KCNH2ALDH1A1
SCHEMBL2829438 0.83 HRH3 (0.45) HRH3KCNH2ALDH1A1
SCHEMBL1498101 0.83 HRH3 (0.45) HRH3KCNH2ALDH1A1
SCHEMBL4892953 0.83 HRH3 (0.45) HRH3KCNH2ALDH1A1
SCHEMBL1498035 0.83 HRH3 (0.45) HRH3KCNH2ALDH1A1
SCHEMBL1506295 0.81 HRH3 (0.65) HRH3KCNH2
SCHEMBL1506417 0.81 HRH3 (0.65) HRH3KCNH2

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-2298734-A2 Cyclobutyl amine derivatives Abbott Laboratories (US) 2011-03-23 EP claimed
US-20090227593-A1 CYCLOBUTYL AMINE DERIVATIVES ABBOTT LABORATORIES (US) 2009-09-10 US claimed
US-7553964-B2 Cyclobutyl amine derivatives ABBOTT LABORATORIES (US) 2009-06-30 US claimed
US-20070078133-A1 Cyclobutyl amine derivatives ABBVIE INC. 2007-04-05 US claimed
EP-1888523-B1 CYCLOBUTYL AMINE DERIVATIVES ABBOTT LAB (US) 2011-10-26 EP disclosed
EP-2298734-A2 Cyclobutyl amine derivatives Abbott Laboratories (US) 2011-03-23 EP disclosed
US-20090227593-A1 CYCLOBUTYL AMINE DERIVATIVES ABBOTT LABORATORIES (US) 2009-09-10 US disclosed
US-7553964-B2 Cyclobutyl amine derivatives ABBOTT LABORATORIES (US) 2009-06-30 US disclosed
US-20070078133-A1 Cyclobutyl amine derivatives ABBVIE INC. 2007-04-05 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-20090227593-A1 CYCLOBUTYL AMINE DERIVATIVES HRH2, HRH4, HRH3 HRH3 3/4885KCNH2 1616/4885ALDH1A1 1245/4885
US-20070078133-A1 Cyclobutyl amine derivatives HRH2, HRH4, HRH3 HRH3 3/4885KCNH2 1616/4885ALDH1A1 1245/4885

“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.