SCHEMBL28060463

SCHEMBL28060463

C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 2/20 0.50
USP2 O75604 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NR1H2 P55055 1/20 0.42
HPGD P15428 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
EPHX2 P34913 1/20 0.40
SMARCA2 P51531 1/20 0.40
SMARCA4 P51532 1/20 0.40
PBRM1 Q86U86 1/20 0.40
SPR P35270 3/20 0.40
GPR119 Q8TDV5 3/20 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
SCHEMBL4336794 0.90 SETD7 (0.52) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL28055264 0.89 SETD7 (0.51) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL17560369 0.87 SETD7 (0.50) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL26666330 0.87 SETD7 (0.50) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL17560370 0.87 SETD7 (0.50) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL2053722 0.87 SETD7 (0.50) SETD7USP2SMN1; SMN2NR1H2SPR
SCHEMBL18701809 0.86 SETD7 (0.49) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL17560383 0.86 SETD7 (0.49) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL17560385 0.86 SETD7 (0.49) SETD7USP2SMN1; SMN2NR1H2HPGD
SCHEMBL21806131 0.86 SETD7 (0.49) SETD7USP2SMN1; SMN2NR1H2HPGD

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-105399698-A Aromatic heterocyclic derivatives and applications of aromatic heterocyclic derivatives in medicines GUANGDONG HEC PHARMACEUTICAL 2016-03-16 CN disclosed