SCHEMBL31388949

SCHEMBL31388949

Cc1ccc(C(C)(C)C)cc1C1CCC12CCN(C(=O)OC(C)(C)C)CC2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.42
ACACB O00763 6/20 0.42
KMT2A Q03164 2/20 0.42
NAMPT P43490 2/20 0.41
MGLL Q99685 1/20 0.41
MEN1 O00255 1/20 0.40
CYP2C9 P11712 1/20 0.40
KDM4E B2RXH2 1/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN1 P18031 1/20 0.40
PTPN6 P29350 1/20 0.40

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
SCHEMBL31388918 0.88 GPR119 (0.49) GPR119ACACBKMT2ANAMPTMEN1
SCHEMBL30104735 0.83 STS (0.44) GPR119NAMPTMGLLPTPN2PTPN1
SCHEMBL31388969 0.83 GPR119 (0.50) GPR119ACACBKMT2ANAMPTMEN1
SCHEMBL23867968 0.82 MGLL (0.59) GPR119ACACBNAMPTMGLL
SCHEMBL30104720 0.82 MGLL (0.59) GPR119ACACBNAMPTMGLL
SCHEMBL31388944 0.79 GPR119 (0.54) GPR119KMT2ANAMPTPTPN2PTPN1
SCHEMBL31388961 0.77 GPR119 (0.55) GPR119KMT2ANAMPTMEN1PTPN2
SCHEMBL31388941 0.76 GPR119 (0.46) GPR119KMT2AMEN1KDM4E
SCHEMBL23867886 0.76 MGLL (0.58) GPR119NAMPTMGLL
SCHEMBL30104728 0.76 MGLL (0.58) GPR119NAMPTMGLL

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