SCHEMBL2300645

SCHEMBL2300645

CC(C)(C)OC(=O)N1CC(CO[Si](C)(C)C(C)(C)C)CC(COS(C)(=O)=O)C1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.43
NAMPT P43490 1/20 0.35
GPR119 Q8TDV5 10/20 0.35
GLS O94925 2/20 0.34
USP2 O75604 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SCN9A Q15858 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
SCHEMBL15657238 0.86 NR1H2 (0.41) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL16862541 0.86 NR1H2 (0.39) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL2355900 0.85 NR1H2 (0.57) NR1H2NAMPTGLSUSP2SMN1; SMN2
SCHEMBL445759 0.84 NR1H2 (0.51) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL18210171 0.82 NR1H2 (0.46) NR1H2NAMPTGLSUSP2SMN1; SMN2
SCHEMBL371676 0.79 NR1H2 (0.65) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL903879 0.79 NR1H2 (0.65) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL1225473 0.79 NR1H2 (0.65) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL30164990 0.79 NR1H2 (0.57) NR1H2NAMPTGPR119USP2SMN1; SMN2
SCHEMBL343551 0.77 NR1H2 (0.55) NR1H2NAMPTGPR119SCN9A

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-2011103127-A1 TREATMENT OF METABOLIC SYNDROME WITH PIPERIDINE AMIDES AMPLA PHARMACEUTICALS INC. (US) 2011-08-25 WO disclosed