SCHEMBL31034836

SCHEMBL31034836

CCOCOC1CCCN(C(=O)OC(C)(C)C)C1COC1CCC(c2cccc(OCCCC(=O)OC(C)(C)C)n2)CC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 16/20 0.44
GPR119 Q8TDV5 3/20 0.36
ALOX5AP P20292 1/20 0.34
FEN1 P39748 1/20 0.34

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
SCHEMBL31034863 0.86 HCRTR2 (0.49) HCRTR2GPR119
SCHEMBL29666586 0.82 HCRTR2 (0.64) HCRTR2
SCHEMBL31034893 0.77 HCRTR2 (0.48) HCRTR2GPR119
SCHEMBL31034920 0.76 HCRTR2 (0.51) HCRTR2GPR119
SCHEMBL31034880 0.76 HCRTR2 (0.53) HCRTR2
SCHEMBL31034874 0.75 HCRTR2 (0.46) HCRTR2
SCHEMBL31034860 0.74 KLK7 (0.40) HCRTR2GPR119
SCHEMBL31035009 0.74 HCRTR2 (0.46) HCRTR2
SCHEMBL30674779 0.73 HCRTR2 (0.34) HCRTR2GPR119
SCHEMBL31034897 0.72 HCRTR2 (0.41) 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