SCHEMBL6940642

SCHEMBL6940642

[CH2]OC(=O)OC(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
SCHEMBL993741 0.79 ALDH1A1 (0.69)
SCHEMBL4100191 0.76 ALDH1A1 (0.64)
SCHEMBL6363153 0.76 ALDH1A1 (0.64)
SCHEMBL9806977 0.76 ALDH1A1 (0.64)
SCHEMBL1844531 0.76 ALDH1A1 (0.64)
SCHEMBL29084539 0.76 ALDH1A1 (0.64)
SCHEMBL2856429 0.76 ALDH1A1 (0.64)
SCHEMBL11482159 0.76 ALDH1A1 (0.64)
SCHEMBL19501744 0.76 ALDH1A1 (0.64)
SCHEMBL28786 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0641795-B9 CARBAPENEM DERIVATIVE DAIICHI SEIYAKU CO (JP) 2003-01-29 EP claimed
EP-0641795-B1 CARBAPENEM DERIVATIVE DAIICHI SEIYAKU CO (JP) 2002-09-25 EP claimed
EP-0641795-B9 CARBAPENEM DERIVATIVE DAIICHI SEIYAKU CO (JP) 2003-01-29 EP disclosed
EP-0641795-B1 CARBAPENEM DERIVATIVE DAIICHI SEIYAKU CO (JP) 2002-09-25 EP disclosed
US-5583218-A ANTIBIOTICS DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-12-10 US disclosed
US-5559224-A Carbepenem derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1996-09-24 US disclosed
EP-0641795-A1 CARBAPENEM DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1995-03-08 EP disclosed
EP-0368259-B1 Carbapenem derivatives DAIICHI SEIYAKU CO (JP) 1994-07-20 EP disclosed
EP-0368259-A1 Carbapenem derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1990-05-16 EP disclosed