SCHEMBL31035009

SCHEMBL31035009

CCOCOC1CCCN(C(=O)OC(C)(C)C)C1COC1CCC(=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 13/20 0.46
ALDH1A1 P00352 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KLK7 P49862 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
SCHEMBL31034874 0.89 HCRTR2 (0.46) HCRTR2ALDH1A1KLK7
SCHEMBL31034904 0.86 HCRTR2 (0.42) HCRTR2ALDH1A1MEN1KMT2AKLK7
SCHEMBL31034880 0.84 HCRTR2 (0.53) HCRTR2MEN1KMT2AKLK7
SCHEMBL31034826 0.83 HCRTR2 (0.46) HCRTR2
SCHEMBL31034980 0.80 HCRTR2 (0.42) HCRTR2MEN1KMT2AKLK7
SCHEMBL31034897 0.80 HCRTR2 (0.41) HCRTR2
SCHEMBL31034863 0.80 HCRTR2 (0.49) HCRTR2
SCHEMBL31034884 0.80 HCRTR2 (0.38) HCRTR2ALDH1A1MEN1KMT2AKLK7
SCHEMBL31034920 0.79 HCRTR2 (0.51) HCRTR2
SCHEMBL29666709 0.77 HCRTR2 (0.70) HCRTR2

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-4658660-A1 MACROCYCLIC OREXIN RECEPTOR AGONISTS AND USES THEREOF Jazz Pharmaceuticals Ireland Limited (IE) 2025-12-10 EP disclosed
WO-2024160822-A1 MACROCYCLIC OREXIN RECEPTOR AGONISTS AND USES THEREOF JAZZ PHARMACEUTICALS IRELAND LIMITED (IE) 2024-08-08 WO disclosed