SCHEMBL9020398

SCHEMBL9020398

CC(C)(C)OC(=O)N1C[C@H](O[Si](C)(C)C(C)(C)C)C[C@H]1C1CNC(=O)C1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SPR P35270 4/20 0.33
AR P10275 1/20 0.32
PARP1 P09874 1/20 0.32
NR1H2 P55055 1/20 0.31
HSD11B1 P28845 1/20 0.31
GPR119 Q8TDV5 3/20 0.31
CHRM2 P08172 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30

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
SCHEMBL8106545 0.89 SPR (0.34) SPRARPARP1HSD11B1GPR119
SCHEMBL31040365 0.89 SPR (0.34) SPRARPARP1HSD11B1GPR119
SCHEMBL9399192 0.85 NR1H2 (0.34) SPRARPARP1NR1H2CHRM2
SCHEMBL9020513 0.84 PARP1 (0.32) ARPARP1
SCHEMBL9020453 0.83 AR (0.34) SPRARPARP1NR1H2HSD11B1
SCHEMBL9400105 0.82 NR1H2 (0.35) SPRARNR1H2HSD11B1CHRM2
SCHEMBL8106582 0.81 CHRM2 (0.33) SPRARPARP1NR1H2HSD11B1
SCHEMBL9754712 0.81 CHRM2 (0.33) SPRARPARP1NR1H2HSD11B1
SCHEMBL31040353 0.81 NR1H2 (0.35) SPRARNR1H2CHRM2CHRM1
SCHEMBL9020512 0.80 AR (0.34) SPRARPARP1HSD11B1GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0449191-B1 2-(Substituted pyrrolidinylthio)carbapenem derivatives BANYU PHARMA CO LTD (JP) 1996-07-03 EP disclosed
US-5438054-A Antibacterial agent BANYU PHARMACEUTICAL CO., LTD. (JP) 1995-08-01 US disclosed
US-5374720-A A thienamycins bactericides has nontoxic, side effect reduction against the kidney and central nervous system BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-12-20 US disclosed
WO-1991014687-A1 2-(SUBSTITUTED PYRROLIDINYLTHIO)CARBAPENEM DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-10-03 WO disclosed
EP-0449191-A1 2-(Substituted pyrrolidinylthio)carbapenem derivatives Banyu Pharmaceutical Co., Ltd. (JP) 1991-10-02 EP disclosed