SCHEMBL8626065

SCHEMBL8626065

O=C(Br)Cc1cccs1

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
SCHEMBL7353467 0.82 HPGD (0.60)
SCHEMBL3757996 0.80
SCHEMBL621289 0.80
Hydrochloric Acid SCHEMBL1372448 0.78 CYP2C19 (0.57)
SCHEMBL11167825 0.78
SCHEMBL9285235 0.78 CYP2C19 (0.57)
SCHEMBL42105 0.78
SCHEMBL10484325 0.78 CYP2C19 (0.57)
SCHEMBL681510 0.78
SCHEMBL1170674 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115557865-A Thioether-promoted cysteine-based bioconjugation method 南京工业大学 2023-01-03 CN claimed
CN-105254650-A Synthesis method of antibacterial drug cefoxitin SICHUAN QINGSHANLVSHUI IND DEV CO LTD 2016-01-20 CN claimed
CN-105254650-A Synthesis method of antibacterial drug cefoxitin SICHUAN QINGSHANLVSHUI IND DEV CO LTD 2016-01-20 CN disclosed
CN-103012437-B The preparation method of antibacterial drugs cefoxitin acid SHANDONG XINQUAN PHARMACEUTICAL CO., LTD. (CN) 2015-08-05 CN disclosed
EP-0503597-B1 Penam derivatives and processes for producing the same OTSUKA KAGAKU KK (JP) 1998-06-10 EP disclosed
US-5599925-A BACTERICIDES OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1997-02-04 US disclosed
EP-0503597-A2 Penam derivatives and processes for producing the same OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1992-09-16 EP disclosed