SCHEMBL16012006

SCHEMBL16012006

CC1CCC(Oc2cc(Br)ccn2)CN1C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 20/20 0.66
HCRTR2 O43614 20/20 0.66

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
SCHEMBL16012260 0.87 HCRTR1 (0.52) HCRTR1HCRTR2
SCHEMBL16011820 0.85 HCRTR1 (0.60) HCRTR1HCRTR2
SCHEMBL16025426 0.85 HCRTR1 (0.60) HCRTR1HCRTR2
SCHEMBL16012166 0.85 HCRTR1 (0.68) HCRTR1HCRTR2
SCHEMBL14876813 0.83 HCRTR2 (0.69) HCRTR1HCRTR2
SCHEMBL16198556 0.83 HCRTR2 (0.67) HCRTR1HCRTR2
SCHEMBL16012406 0.82 HCRTR2 (0.68) HCRTR1HCRTR2
SCHEMBL16198125 0.80 HCRTR1 (1.00) HCRTR1HCRTR2
SCHEMBL25342628 0.80 HCRTR1 (0.46) HCRTR1HCRTR2
SCHEMBL16012550 0.79 HCRTR1 (0.70) HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9745284-B2 2-pyridyloxy-4-ether orexin receptor antagonists MERCK SHARP & DOHME CORP. (US) 2017-08-29 US disclosed
US-20160016935-A1 2-PYRIDYLOXY-4-ETHER OREXIN RECEPTOR ANTAGONISTS MERCK SHARP & DOHME CORP. (US) 2016-01-21 US disclosed
EP-2964226-A1 2-PYRIDYLOXY-4-ETHER OREXIN RECEPTOR ANTAGONISTS Merck Sharp & Dohme Corp. (US) 2016-01-13 EP disclosed
WO-2014137883-A1 2-PYRIDYLOXY-4-ETHER OREXIN RECEPTOR ANTAGONISTS MERCK SHARP & DOHME CORP. (US) 2014-09-12 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-20160016935-A1 2-PYRIDYLOXY-4-ETHER OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPY2R HCRTR1 2/4885HCRTR2 1/4885

“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.