SCHEMBL5283558

SCHEMBL5283558

COC(=O)c1cnc(N2CCC(OC3CCN(C4CCC4)CC3)CC2)cn1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.54
SMO Q99835 1/20 0.48
OPRK1 P41145 1/20 0.42

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
SCHEMBL5785181 0.94 HRH3 (0.49) HRH3SMOOPRK1
SCHEMBL4031091 0.88 HRH3 (0.51) HRH3SMOOPRK1
SCHEMBL5211294 0.88 HRH3 (0.50) HRH3
SCHEMBL5213075 0.87 HRH3 (0.46) HRH3
Hydrochloric Acid SCHEMBL5210651 0.86 HRH3 (0.48) HRH3
Hydrochloric Acid SCHEMBL5213349 0.85 HRH3 (0.47) HRH3
SCHEMBL5209745 0.85 HRH3 (0.49) HRH3
SCHEMBL5212822 0.84 ACKR3 (0.46) HRH3
SCHEMBL5211024 0.83 HRH3 (0.43) HRH3
SCHEMBL24033271 0.80 OPRK1 (0.49) HRH3SMOOPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1646620-B1 SUBSTITUTED PIPERIDINES AS HISTAMINE H3 RECEPTOR LIGANDS GLAXO GROUP LTD (GB) 2007-08-15 EP disclosed
US-20060247227-A1 Substituted piperidines as histamine h3 receptor ligands BAILEY JAMES M 2006-11-02 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-20060247227-A1 Substituted piperidines as histamine h3 receptor ligands HRH3, HRH4, HRH1 HRH3 1/4885SMO 1395/4885OPRK1 53/4885

“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.