SCHEMBL29132073

SCHEMBL29132073

C[C@H]1CN(C(=O)O)CCN1CC1CN(C(=O)OC(C)(C)C)C1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.45
NAMPT P43490 1/20 0.39
GPR119 Q8TDV5 5/20 0.37
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
KDM4E B2RXH2 1/20 0.36
PKM P14618 1/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
SETD7 Q8WTS6 1/20 0.35
HPGD P15428 1/20 0.35
EPHX2 P34913 1/20 0.35

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
SCHEMBL29132076 1.00 NR1H2 (0.45) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL26926054 0.90 KDM4E (0.45) NR1H2GPR119USP2SMN1; SMN2KDM4E
SCHEMBL26926233 0.90 KDM4E (0.45) NR1H2GPR119USP2SMN1; SMN2KDM4E
SCHEMBL26926046 0.90 KDM4E (0.45) NR1H2GPR119USP2SMN1; SMN2KDM4E
SCHEMBL28721922 0.85 NR1H2 (0.48) NR1H2GPR119USP2SMN1; SMN2MEN1
SCHEMBL28721924 0.85 NR1H2 (0.48) NR1H2GPR119USP2SMN1; SMN2MEN1
SCHEMBL28938073 0.85 NR1H2 (0.48) NR1H2GPR119USP2SMN1; SMN2MEN1
SCHEMBL29132091 0.81 KDM4E (0.44) GPR119KDM4EPKMALDH1A1MAPT
SCHEMBL25338213 0.81 NR1H2 (0.49) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL23860095 0.81 USP2 (0.42) NR1H2USP2SMN1; SMN2ALDH1A1SETD7

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-117321046-A Indazole-based compounds and related methods of use 阿维纳斯企业公司 2023-12-29 CN disclosed