SCHEMBL28136162

SCHEMBL28136162

CO[C@H]1CN(C(=O)OC(C)(C)C)CCN1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NR1H2 P55055 1/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RECQL P46063 1/20 0.38
EPHX1 P07099 1/20 0.38
KDM4E B2RXH2 1/20 0.38
THRB P10828 1/20 0.38
EPHX2 P34913 1/20 0.37
PDE4B Q07343 1/20 0.36
GPR119 Q8TDV5 1/20 0.36
MMP1 P03956 1/20 0.36
MMP3 P08254 1/20 0.36
MMP7 P09237 1/20 0.36
MMP9 P14780 1/20 0.36

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
SCHEMBL28127594 1.00 USP2 (0.42) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL13073441 0.85 USP2 (0.39) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL27752719 0.85 USP2 (0.41) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL2561810 0.85 USP2 (0.41) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL19051326 0.84 USP2 (0.40) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL1005678 0.83 USP2 (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL1005680 0.83 USP2 (0.44) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL105348 0.82 NR1H2 (0.47) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL16018 0.82 NR1H2 (0.47) USP2SMN1; SMN2NR1H2MAPK1MAPT
SCHEMBL16843 0.82 NR1H2 (0.47) USP2SMN1; SMN2NR1H2MAPK1MAPT

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-106573928-A 2-aminothiazole derivative or salt thereof 安斯泰来制药株式会社 2017-04-19 CN disclosed