SCHEMBL7186277

SCHEMBL7186277

COc1ccc(COC(=O)C2=CS[C@H]3N2C(=O)C3(Br)C(OC(C)=O)c2cn3c(n2)[S+]([O-])CC3)cc1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.31

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
SCHEMBL8386728 0.85 TSHR (0.33) ELANE
SCHEMBL7176683 0.85 TSHR (0.33) ELANE
SCHEMBL8889527 0.84 ELANE (0.32) ELANE
SCHEMBL8809738 0.81 ELANE (0.33) ELANE
SCHEMBL2922953 0.76 PLCG1 (0.33)
SCHEMBL2927442 0.76 MAPT (0.34)
SCHEMBL3555617 0.76 PLCG1 (0.33)
SCHEMBL3555614 0.76 PLCG1 (0.33)
SCHEMBL3048181 0.76 PLCG1 (0.33)
SCHEMBL8889333 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758240-B1 PHARMACEUTICAL FORMULATIONS CONTAINING A BETA-LACTAMASE INHIBITING PENEM IN COMBINATION WITH A BETA-LACTAM ANTIBIOTIC AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS SMITHKLINE BEECHAM PLC (GB) 2003-10-29 EP disclosed
US-6472383-B1 Pharmaceutical formulations SMITHKLINE BEECHAM P.L.C. (GB) 2002-10-29 US disclosed
US-6037469-A BETA LACTAMASE INHIBITOR AND ANTIBACTERIAL; FOR TREATING BACTERIAL INFECTIONS IN HUMANS AND ANIMALS SMITHKLINE BEECHAM PLC (GB) 2000-03-14 US disclosed
US-5939066-A TREATING OR PREVENTING A BACTERIAL INFECTION BY ADMINISTERING A LACTAMASE INHIBITORY EFFECTIVE AMOUNT OF A PENEM AND A LACTAM ANTIBIOTIC SMITHKLINE BEECHAM P.L.C. 1999-08-17 US disclosed
US-5911985-A IN COMBINATION WITH CARRIERS AND A LACTAM ANTIBIOTIC SMITHKLINE BEECHAM P.L.C. (GB) 1999-06-15 US disclosed
US-5776455-A PENICILLIN BACTERICIDES SMITHKLINE BEECHAM P.L.C. (GB) 1998-07-07 US disclosed
US-5602250-A ANTIBIOTICS, BETA-LACTAMASE INHIBITORS SMITHKLINE BEECHAM P.L.C. (GB) 1997-02-11 US disclosed
WO-1995028935-A1 PHARMACEUTICAL FORMULATIONS CONTAINING A BETA-LACTAMASE INHIBITING PENEM IN COMBINATION WITH A BETA-LACTAM ANTIBIOTIC AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIONS SMITHKLINE BEECHAM PLC (GB) 1995-11-02 WO disclosed