SCHEMBL31286151

SCHEMBL31286151

CC1=CCCN(C(=O)OC(C)(C)C)C1C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.37
NR1H2 P55055 2/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NPC1 O15118 1/20 0.35
MAP4K4 O95819 1/20 0.35
NR1H3 Q13133 1/20 0.34
USP2 O75604 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL29593180 0.87 HSD17B10 (0.40) GPR119NR1H2KMT2ALMNANPSR1
SCHEMBL29593455 0.87 HSD17B10 (0.40) GPR119NR1H2KMT2ALMNANPSR1
SCHEMBL22142845 0.86 GPR119 (0.39) GPR119NR1H2LMNANPSR1NPC1
SCHEMBL22142936 0.86 GPR119 (0.39) GPR119NR1H2LMNANPSR1NPC1
SCHEMBL22142862 0.86 GPR119 (0.39) GPR119NR1H2LMNANPSR1NPC1
SCHEMBL29929712 0.78 MEN1 (0.43) GPR119NR1H2KMT2ALMNANPSR1
SCHEMBL22142000 0.75 MAPK1 (0.37) GPR119NR1H2NPC1USP2SMN1; SMN2
SCHEMBL22142007 0.75 MAPK1 (0.37) GPR119NR1H2NPC1USP2SMN1; SMN2
SCHEMBL22142011 0.75 MAPK1 (0.37) GPR119NR1H2NPC1USP2SMN1; SMN2
SCHEMBL27533386 0.74 GPR119 (0.36) GPR119NR1H2NPC1USP2SMN1; SMN2

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
CN-114591223-B Beta-lactamase inhibitor compounds 恩塔西斯治疗有限公司 2025-01-24 CN disclosed