SCHEMBL3476912

SCHEMBL3476912

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

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
DDB1 Q16531 4/20 0.36
CRBN Q96SW2 4/20 0.36
GPR119 Q8TDV5 1/20 0.35
ESR2 Q92731 1/20 0.35
ADORA1 P30542 1/20 0.35
USP30 Q70CQ3 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.35
MAPK1 P28482 1/20 0.35
RORC P51449 1/20 0.34

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
SCHEMBL571435 0.89 USP2 (0.46) NR1H2USP2SMN1; SMN2GPR119RORC
SCHEMBL120243 0.83 USP2 (0.50) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL571118 0.78 USP2 (0.46) USP2SMN1; SMN2GPR119USP30RORC
SCHEMBL20765932 0.77 USP2 (0.47) NR1H2USP2SMN1; SMN2GPR119ESR2
SCHEMBL14800964 0.77 USP2 (0.52) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL995131 0.77 USP2 (0.52) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL26409745 0.75 USP2 (0.46) NR1H2USP2SMN1; SMN2GPR119
Hydrochloric Acid SCHEMBL26689433 0.75 USP2 (0.50) NR1H2USP2SMN1; SMN2DDB1CRBN
SCHEMBL30694561 0.75 SCD5 (0.40) NR1H2USP2SMN1; SMN2GPR119
SCHEMBL22405855 0.75 HPGD (0.44) USP2SMN1; SMN2GPR119USP30MAPT

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-2010132777-A2 TREATMENT OF URINARY TRACT INFECTIONS WITH ANTIBACTERIAL AMINOGLYCOSIDE COMPOUNDS ACHAOGEN, INC. (US) 2010-11-18 WO disclosed