SCHEMBL863272

SCHEMBL863272

CN1CCC(N2CCC3(CC2)Cc2cc(-c4ccc5[nH]ccc5c4)ccc2O3)CC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CREBBP Q92793 1/20 0.40
HRH3 Q9Y5N1 17/20 0.39
KCNH2 Q12809 3/20 0.38
CYP2D6 P10635 1/20 0.38
CHRNA7 P36544 2/20 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
SCHEMBL863237 0.92 HRH3 (0.47) HRH3KCNH2CYP2D6
SCHEMBL10191794 0.82 HRH3 (0.41) HRH3KCNH2CYP2D6
SCHEMBL863631 0.80 CREBBP (0.39) CREBBPHRH3CYP2D6CHRNA7
SCHEMBL10191720 0.79 HRH3 (0.41) HRH3KCNH2CYP2D6
SCHEMBL863670 0.78 HRH3 (0.44) HRH3KCNH2CYP2D6
SCHEMBL863693 0.78 HRH3 (0.40) HRH3KCNH2CYP2D6
SCHEMBL863261 0.78 HRH3 (0.41) HRH3KCNH2CYP2D6
SCHEMBL864456 0.78 HRH3 (0.46) HRH3KCNH2CYP2D6
SCHEMBL10191702 0.77 HRH3 (0.43) HRH3KCNH2CYP2D6
SCHEMBL10191798 0.77 HRH3 (0.38) HRH3KCNH2CYP2D6

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 CREBBP 892/4885HRH3 1/4885KCNH2 605/4885

“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.