SCHEMBL31034976

SCHEMBL31034976

CCOCOC1CCCN(C(=O)OC(C)(C)C)C1COC1CC=C(c2c(F)cccc2OCc2ccccc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.40
HCRTR2 O43614 9/20 0.39
GHSR Q92847 4/20 0.34
GPR119 Q8TDV5 1/20 0.34
HTR1A P08908 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
TSHR P16473 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PRMT5 O14744 1/20 0.32

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
SCHEMBL31034860 0.85 KLK7 (0.40) KLK7HCRTR2GHSRGPR119MEN1
SCHEMBL31034880 0.80 HCRTR2 (0.53) KLK7HCRTR2MEN1KMT2A
SCHEMBL31034893 0.77 HCRTR2 (0.48) HCRTR2GPR119
SCHEMBL23391527 0.77 HCRTR2 (0.40) HCRTR2TSHRL3MBTL1
SCHEMBL31034920 0.76 HCRTR2 (0.51) HCRTR2GPR119
SCHEMBL31034980 0.75 HCRTR2 (0.42) KLK7HCRTR2GPR119MEN1KMT2A
SCHEMBL31702642 0.74 KLK7 (0.32) KLK7GHSRGPR119HTR1ASLC6A2
SCHEMBL27282775 0.74 KLK7 (0.32) KLK7GHSRGPR119HTR1ASLC6A2
SCHEMBL31035009 0.73 HCRTR2 (0.46) KLK7HCRTR2MEN1KMT2A
SCHEMBL31034884 0.72 HCRTR2 (0.38) KLK7HCRTR2GPR119L3MBTL1MEN1

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