SCHEMBL9116509

SCHEMBL9116509

C[CH]CC(O)C(=O)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
Propene SCHEMBL11462760 0.93 OR51E2 (0.40)
Propene SCHEMBL10375990 0.93 OR51E2 (0.40)
SCHEMBL9565293 0.79
SCHEMBL9565291 0.79
SCHEMBL20816993 0.77 GRIK1 (0.40)
SCHEMBL6129577 0.74
SCHEMBL2720035 0.74
SCHEMBL6129552 0.74
SCHEMBL16579852 0.74 GRIK1 (0.48)
SCHEMBL27348229 0.74 OR51E2 (0.42)

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-106715536-B Platinum (II) diene complexes for controlled siloxane crosslinking 莫门蒂夫性能材料股份有限公司 2021-06-01 CN claimed
CN-106715536-B Platinum (II) diene complexes for controlled siloxane crosslinking 莫门蒂夫性能材料股份有限公司 2021-06-01 CN disclosed
WO-1995022519-A1 SYNTHESIS OF POLYHYDROXY FATTY ACID AMIDES FROM TRIGLYCERIDES THE PROCTER & GAMBLE COMPANY (US) 1995-08-24 WO disclosed
EP-0019345-B1 PROCESS FOR THE PREPARATION OF A (D-ALPHA-AMINO-(P-HYDROXYPHENYL)-ACETAMIDO) GROUP CONTAINING CEPHALOSPORANIC ACID DERIVATIVES GIST-BROCADES N.V. (NL) 1985-06-19 EP disclosed
EP-0019345-A1 Process for the preparation of a (D-alpha-amino-(p-hydroxyphenyl)-acetamido) group containing cephalosporanic acid derivatives GIST-BROCADES N.V. (NL) 1980-11-26 EP disclosed
EP-0001133-A1 Process for the preparation of 6- D-alpha-amino-(p-hydroxyphenyl)-acetamido penicillanic acid GIST-BROCADES N.V. (NL) 1979-03-21 EP disclosed
US-3970651-A ANTIBIOTIC BRISTOL-MYERS COMPANY (US) 1976-07-20 US disclosed