SCHEMBL6958889

SCHEMBL6958889

CN(C)S(=O)(=O)N1CCN(C2CN(C(=O)OC(C)(C)C)C2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.47
NR1H2 P55055 1/20 0.43
TGM2 P21980 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
USP2 O75604 1/20 0.38
JAK2 O60674 1/20 0.38
JAK1 P23458 1/20 0.38
ALDH1A1 P00352 2/20 0.37
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
GPR119 Q8TDV5 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 1/20 0.36
PREP P48147 1/20 0.36
F13A1 P00488 1/20 0.35
TGM1 P22735 1/20 0.35

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
SCHEMBL6951547 0.85 NR1H2 (0.46) NR1H2SMN1; SMN2USP2GPR119HPGD
SCHEMBL6957235 0.85 ALDH1A1 (0.46) NR1H2SMN1; SMN2USP2ALDH1A1GPR119
SCHEMBL6853359 0.84 GAA (0.64) GAATGM2SMN1; SMN2USP2ALDH1A1
SCHEMBL7814135 0.81 NR1H2 (0.43) NR1H2TGM2SMN1; SMN2USP2GPR119
SCHEMBL20523370 0.80 GPR119 (0.43) GAANR1H2TGM2SMN1; SMN2USP2
SCHEMBL6963497 0.79 SMN1; SMN2 (0.52) NR1H2SMN1; SMN2USP2GPR119L3MBTL1
SCHEMBL21302145 0.78 NR1H2 (0.46) NR1H2SMN1; SMN2USP2ALDH1A1GPR119
SCHEMBL24359058 0.78 NR1H2 (0.49) NR1H2SMN1; SMN2USP2ALDH1A1GPR119
SCHEMBL15664395 0.78 HPGD (0.51) NR1H2SMN1; SMN2USP2ALDH1A1GPR119
SCHEMBL26101858 0.77 NR1H2 (0.45) NR1H2SMN1; SMN2USP2ALDH1A1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0791592-B1 Azetidines PFIZER LTD (GB) 2003-05-21 EP disclosed
US-6022971-A Azetidines PFIZER INC (US) 2000-02-08 US disclosed
US-5741790-A Azetidines PFIZER INC. (US) 1998-04-21 US disclosed
EP-0791592-A2 Azetidines Pfizer Limited (GB) 1997-08-27 EP disclosed