SCHEMBL9027157

SCHEMBL9027157

C=CCOC(=O)N1CC(OS(C)(=O)=O)CC1Cc1ccnc(C#N)c1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.33
ANPEP P15144 1/20 0.33
SIGMAR1 Q99720 1/20 0.31
GRM2 Q14416 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
SCHEMBL9027149 1.00 MMP2 (0.33) MMP2ANPEPSIGMAR1GRM2
SCHEMBL9027754 0.88 MMP2 (0.34) MMP2ANPEPSIGMAR1
SCHEMBL9027764 0.88 MMP2 (0.34) MMP2ANPEPSIGMAR1
SCHEMBL9026560 0.87 PDCD1 (0.34) SIGMAR1GRM2
SCHEMBL9026520 0.86 MMP2 (0.35) MMP2ANPEPSIGMAR1
SCHEMBL9027013 0.85 SIGMAR1 (0.30) SIGMAR1
SCHEMBL9027017 0.85 SIGMAR1 (0.30) SIGMAR1
SCHEMBL9027880 0.84 FNTA (0.33) SIGMAR1GRM2
SCHEMBL9027888 0.84 FNTA (0.33) SIGMAR1GRM2
SCHEMBL8833776 0.79 SIGMAR1 (0.33) MMP2ANPEPSIGMAR1

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-0722447-A1 3-PYRROLIDINYLTHIO-CARBAPENEM DERIVATIVES AND THEIR ANTIMICROBAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-07-24 EP disclosed
WO-1995010520-A1 3-PYRROLIDINYLTHIO-CARBAPENEM DERIVATIVES AND THEIR ANTIMICROBAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1995-04-20 WO disclosed