SCHEMBL8288797

SCHEMBL8288797

CC(C)(C)OC(=O)n1cc2c(=O)c2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
USP2 O75604 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BUB1 O43683 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
GPR119 Q8TDV5 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NR1H2 P55055 1/20 0.34
DTYMK P23919 2/20 0.33
POLB P06746 1/20 0.33
HTR6 P50406 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
HTT P42858 1/20 0.33
ATM Q13315 1/20 0.33

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
SCHEMBL15252478 0.79 BCHE (0.40) BCHEMEN1KMT2AUSP2SMN1; SMN2
SCHEMBL28813437 0.79 KMT2A (0.41) BCHEMEN1KMT2AUSP2SMN1; SMN2
SCHEMBL30745933 0.78 GABRA1 (0.44) BCHEMEN1KMT2AL3MBTL1
SCHEMBL15252551 0.76 PDE4B (0.38) BCHEMEN1KMT2AUSP2SMN1; SMN2
SCHEMBL27927848 0.76 USP2 (0.39) BCHEMEN1KMT2AUSP2SMN1; SMN2
SCHEMBL13559889 0.76 BCHE (0.41) BCHEMEN1KMT2AUSP2SMN1; SMN2
SCHEMBL5184141 0.74 BCHE (0.47) BCHEMEN1KMT2AGPR119L3MBTL1
SCHEMBL1960456 0.73 MEN1 (0.37) BCHEMEN1KMT2AUSP2SMN1; SMN2
SCHEMBL28970109 0.72 UCHL1 (0.37) BCHEMEN1KMT2AGPR119L3MBTL1
SCHEMBL3246759 0.72 BCHE (0.41) BCHEMEN1KMT2AUSP2SMN1; SMN2

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
WO-2005058317-A1 GLYCINE TRANSPORTER-1 INHIBIRORS GLAXO GROUP LIMITED (GB) 2005-06-30 WO disclosed