SCHEMBL4964178

SCHEMBL4964178

N#CCC(S)[C]=O

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
SCHEMBL8894513 0.75
SCHEMBL7901703 0.75
Water SCHEMBL5355054 0.67
SCHEMBL14941161 0.65
SCHEMBL10931857 0.65
SCHEMBL1268151 0.65
SCHEMBL2526540 0.63
SCHEMBL902586 0.63
SCHEMBL5503133 0.63
SCHEMBL26119248 0.63

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920527-B1 SYNTHESIS OF beta-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL MYERS SQUIBB CO (US) 2008-03-19 EP claimed
US-20030044884-A1 Synthesis of beta-lactam antibacterials using soluble side chain esters and enzyme acylase USHER JOHN J (US) 2003-03-06 US claimed
EP-0920527-A4 SYNTHESIS OF beta-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL MYERS SQUIBB CO (US) 2003-03-05 EP claimed
EP-0920527-A1 SYNTHESIS OF beta-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-06-09 EP claimed
WO-1998004732-A1 SYNTHESIS OF β-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL-MYERS SQUIBB COMPANY (US) 1998-02-05 WO claimed
EP-0363223-A2 3-Aryloxymethyl-cephalosporin derivatives, their preparation and their medical use Sankyo Company Limited (JP) 1990-04-11 EP claimed
US-4888332-A ANTIBIOTICS MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1989-12-19 US claimed
CN-113512046-B C-7-position halogenated acyl cephalosporin compound, preparation method and application 西南大学 2023-04-25 CN disclosed
EP-0920527-B1 SYNTHESIS OF beta-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL MYERS SQUIBB CO (US) 2008-03-19 EP disclosed
US-20030044884-A1 Synthesis of beta-lactam antibacterials using soluble side chain esters and enzyme acylase USHER JOHN J (US) 2003-03-06 US disclosed
EP-0920527-A4 SYNTHESIS OF beta-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL MYERS SQUIBB CO (US) 2003-03-05 EP disclosed
US-6156534-A Synthesis of β-lactam antibacterials using soluble side chain esters and enzyme acylase BRISTOL-MYERS SQUIBB COMPANY (US) 2000-12-05 US disclosed
US-5922907-A A CHEMICAL INTERMEDIATE PHENYLGLYCYL HYDROXYETHYL ESTER OR 4-PHENYLGLYCYL HYDROXYETHYL ESTER BRISTOL-MYERS SQUIBB CO. (US) 1999-07-13 US disclosed
EP-0920527-A1 SYNTHESIS OF beta-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL-MYERS SQUIBB COMPANY (US) 1999-06-09 EP disclosed
WO-1998004732-A1 SYNTHESIS OF β-LACTAM ANTIBACTERIALS USING SOLUBLE SIDE CHAIN ESTERS AND ENZYME ACYLASE BRISTOL-MYERS SQUIBB COMPANY (US) 1998-02-05 WO disclosed
EP-0229369-A2 Cephalosporins, process for their preparation and pharmaceutical compositions containing them Takeda Chemical Industries, Ltd. (JP) 1987-07-22 EP disclosed
EP-0225634-A2 Antibacterial compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1987-06-16 EP disclosed