SCHEMBL7183355

SCHEMBL7183355

COc1ccc(COC(=O)C2=CS[C@@H]3C(=Cc4cn5c(n4)S(=O)(=O)CCC5)C(=O)N23)cc1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8888119 0.95
SCHEMBL8886891 0.85
SCHEMBL8887804 0.83
SCHEMBL8889333 0.81
SCHEMBL7175360 0.80
SCHEMBL8128666 0.79
SCHEMBL7203141 0.78 MEN1 (0.31)
SCHEMBL7183624 0.75
SCHEMBL8136114 0.74
SCHEMBL8888122 0.73 MEN1 (0.30)

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-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
EP-0666862-B1 6-(SUBSTITUTED METHYLENE) PENEMS AND INTERMEDIATES SMITHKLINE BEECHAM PLC (GB) 2000-04-19 EP disclosed