SCHEMBL863695

SCHEMBL863695

c1cn2cc(-c3ccc4c(c3)CC3(CCN5CCCCC5C3)O4)ccc2n1

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.38
TRIM33 Q9UPN9 1/20 0.36
TRIM24 O15164 1/20 0.35
NAMPT P43490 2/20 0.35
DYRK1A Q13627 2/20 0.35
FAAH O00519 1/20 0.35

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
SCHEMBL7858589 1.00 HRH3 (0.38) HRH3TRIM33TRIM24NAMPTDYRK1A
SCHEMBL7859083 1.00 HRH3 (0.38) HRH3TRIM33TRIM24NAMPTDYRK1A
SCHEMBL7849203 1.00 HRH3 (0.38) HRH3TRIM33TRIM24NAMPTDYRK1A
SCHEMBL7849750 1.00 HRH3 (0.38) HRH3TRIM33TRIM24NAMPTDYRK1A
SCHEMBL10191844 1.00 HRH3 (0.38) HRH3TRIM33TRIM24NAMPTDYRK1A
SCHEMBL864935 0.97 HRH3 (0.39) HRH3TRIM33DYRK1AFAAH
SCHEMBL863643 0.96 TRIM33 (0.36) HRH3TRIM33TRIM24NAMPTDYRK1A
SCHEMBL863881 0.94 DYRK1A (0.36) HRH3TRIM33TRIM24NAMPTDYRK1A
SCHEMBL863270 0.93 HRH3 (0.40) HRH3
SCHEMBL863825 0.91 HRH3 (0.45) HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2440563-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF Sunovion Pharmaceuticals Inc. (US) 2012-04-18 EP disclosed
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-03-29 US disclosed
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-03-29 US disclosed
US-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC. (US) 2012-03-29 US disclosed
WO-2010144571-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SEPRACOR INC. (US) 2010-12-16 WO disclosed
WO-2010144571-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF SEPRACOR INC. (US) 2010-12-16 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 (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-20120077802-A1 HISTAMINE H3 INVERSE AGONISTS AND ANTAGONISTS AND METHODS OF USE THEREOF HRH3, HRH4, HRH2 HRH3 1/4885TRIM33 4066/4885TRIM24 4537/4885

“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.