SCHEMBL22077652

SCHEMBL22077652

CC(CCN)N1OCCC1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 1/20 0.31

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
SCHEMBL1698565 0.74
SCHEMBL22648394 0.66 LMNA (0.49) GABBR2GABBR1
SCHEMBL3762756 0.64 GABBR2 (0.33) GABBR2GABBR1
SCHEMBL1698508 0.63 PIK3CD (0.35)
SCHEMBL2928895 0.62
SCHEMBL10585672 0.60 TACR1 (0.37)
SCHEMBL4418973 0.59 GABBR2 (0.35) GABBR2GABBR1
SCHEMBL4856749 0.59 KMT2A (0.46) GABBR2GABBR1
SCHEMBL6759554 0.58
SCHEMBL1708922 0.58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020115506-A1 QUINOLINONE AND BENZOXAZINE DERIVATIVES AS MUSCARINIC M1 AND/OR M4 RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2020-06-11 WO disclosed