SCHEMBL3400129

SCHEMBL3400129

CC(C)(C)OC(=O)N1CC(OCCC2CCNCC2)C1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.49
TPSAB1 Q15661 2/20 0.38
TPSD1 Q9BZJ3 2/20 0.38
TPSG1 Q9NRR2 2/20 0.38
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
NAMPT P43490 1/20 0.37
GPR119 Q8TDV5 5/20 0.37
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CHEK2 O96017 1/20 0.36
HPGD P15428 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
SCHEMBL13748769 0.88 NR1H2 (0.50) NR1H2PRMT5WDR77DDB1CRBN
SCHEMBL22907300 0.83 NR1H2 (0.51) NR1H2PRMT5WDR77NAMPTGPR119
SCHEMBL22907301 0.82 NR1H2 (0.47) NR1H2PRMT5WDR77DDB1CRBN
SCHEMBL27097891 0.82 NR1H2 (0.54) NR1H2PRMT5WDR77NAMPTGPR119
SCHEMBL27097890 0.82 NR1H2 (0.50) NR1H2PRMT5WDR77NAMPTGPR119
SCHEMBL3401258 0.81 ITGB3 (0.40) TPSAB1TPSD1TPSG1
SCHEMBL27097889 0.81 NR1H2 (0.49) NR1H2PRMT5WDR77NAMPTGPR119
SCHEMBL27097888 0.81 NR1H2 (0.49) NR1H2PRMT5WDR77NAMPTGPR119
SCHEMBL27136519 0.81 NR1H2 (0.49) NR1H2PRMT5WDR77NAMPTGPR119
SCHEMBL18921586 0.80 NR1H2 (0.54) NR1H2DDB1CRBNNAMPTMEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2252613-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM, LLC (BM) 2010-11-24 EP disclosed
WO-2009105717-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF GPR119 ACTIVITY IRM LLC (BM) 2009-08-27 WO disclosed