SCHEMBL9026520

SCHEMBL9026520

C=CCOC(=O)N1C[C@H](OS(C)(=O)=O)C[C@H]1Cc1ccnc(C(N)=O)c1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.35
ANPEP P15144 1/20 0.35
OPRM1 P35372 5/20 0.32
OPRK1 P41145 1/20 0.32
KCNH2 Q12809 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
F10 P00742 2/20 0.32
PLG P00747 2/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
F2 P00734 1/20 0.31
CYP4F2 P78329 1/20 0.31
CYP4A11 Q02928 1/20 0.31
CYP19A1 P11511 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
SCHEMBL9027754 0.89 MMP2 (0.34) MMP2ANPEPSIGMAR1F10PLG
SCHEMBL9027764 0.89 MMP2 (0.34) MMP2ANPEPSIGMAR1F10PLG
SCHEMBL9027157 0.86 MMP2 (0.33) MMP2ANPEPSIGMAR1
SCHEMBL9027149 0.86 MMP2 (0.33) MMP2ANPEPSIGMAR1
SCHEMBL9026999 0.86 OPRK1 (0.33) OPRM1OPRK1KCNH2SIGMAR1CYP4F2
SCHEMBL9027003 0.86 OPRK1 (0.33) OPRM1OPRK1KCNH2SIGMAR1CYP4F2
SCHEMBL9027810 0.84 OPRM1 (0.31) OPRM1OPRK1KCNH2SIGMAR1CYP4F2
SCHEMBL9027814 0.84 OPRM1 (0.31) OPRM1OPRK1KCNH2SIGMAR1CYP4F2
SCHEMBL9027374 0.83 OPRK1 (0.33) OPRM1OPRK1KCNH2SIGMAR1CYP4F2
SCHEMBL9027356 0.83 OPRK1 (0.33) OPRM1OPRK1KCNH2SIGMAR1CYP4F2

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