SCHEMBL9027754

SCHEMBL9027754

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

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.34
ANPEP P15144 1/20 0.34
SIGMAR1 Q99720 1/20 0.33
CYP19A1 P11511 1/20 0.31
F10 P00742 2/20 0.31
PLG P00747 2/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
ITGB1 P05556 3/20 0.30
ITGA5 P08648 3/20 0.30
ITGB3 P05106 2/20 0.30
ITGAV P06756 2/20 0.30
ITGA2B P08514 2/20 0.30
ITGB5 P18084 2/20 0.30
F2 P00734 2/20 0.30
ELANE P08246 1/20 0.30
CTSG P08311 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
SCHEMBL9027764 1.00 MMP2 (0.34) MMP2ANPEPSIGMAR1CYP19A1F10
SCHEMBL9026520 0.89 MMP2 (0.35) MMP2ANPEPSIGMAR1CYP19A1F10
SCHEMBL9027149 0.88 MMP2 (0.33) MMP2ANPEPSIGMAR1
SCHEMBL9027157 0.88 MMP2 (0.33) MMP2ANPEPSIGMAR1
SCHEMBL9027929 0.87 POLB (0.36) SIGMAR1CYP19A1
SCHEMBL9037600 0.84 VHL (0.32) SIGMAR1CYP19A1
SCHEMBL9037597 0.84 VHL (0.32) SIGMAR1CYP19A1
SCHEMBL8833776 0.82 SIGMAR1 (0.33) MMP2ANPEPSIGMAR1CYP19A1
SCHEMBL9220068 0.82 SIGMAR1 (0.33) MMP2ANPEPSIGMAR1CYP19A1
SCHEMBL9026873 0.82 SIGMAR1 (0.33) SIGMAR1CYP19A1

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