SCHEMBL31388944

SCHEMBL31388944

Cc1ccc(C2CCC23CCN(C(=O)OC(C)(C)C)CC3)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.54
KMT2A Q03164 1/20 0.50
TP53 P04637 1/20 0.45
MMP13 P45452 1/20 0.43
PTPN2 P17706 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN6 P29350 1/20 0.43
NAMPT P43490 5/20 0.42
HRH3 Q9Y5N1 2/20 0.42

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
SCHEMBL31388961 0.86 GPR119 (0.55) GPR119KMT2APTPN2PTPN1PTPN6
SCHEMBL31388918 0.85 GPR119 (0.49) GPR119KMT2ATP53NAMPT
SCHEMBL31388969 0.84 GPR119 (0.50) GPR119KMT2ATP53NAMPT
SCHEMBL31388952 0.84 RORC (0.45) GPR119NAMPTHRH3
SCHEMBL31388937 0.80 MAPT (0.51) GPR119HRH3
SCHEMBL30104735 0.80 STS (0.44) GPR119PTPN2PTPN1PTPN6NAMPT
SCHEMBL31388949 0.79 GPR119 (0.42) GPR119KMT2APTPN2PTPN1PTPN6
SCHEMBL12117456 0.79 GPR119 (0.65) GPR119KMT2ATP53MMP13PTPN2
SCHEMBL23867867 0.79 GPR119 (0.52) GPR119KMT2ATP53NAMPT
SCHEMBL31388902 0.78 NOTCH1 (0.48) GPR119KMT2A

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-115362153-B Azaspiro compounds as monoacylglycerol lipase modulators 詹森药业有限公司 2025-01-07 CN disclosed