SCHEMBL8580441

SCHEMBL8580441

CCC(C=O)(OC)OC

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
SCHEMBL4431241 0.78
SCHEMBL4629702 0.74
SCHEMBL3839622 0.74
SCHEMBL5339519 0.74
SCHEMBL7585020 0.74
SCHEMBL1674738 0.74
SCHEMBL8624273 0.74 ADH1B (0.36)
SCHEMBL12128859 0.73
SCHEMBL8923107 0.72 ADH1B (0.38)
SCHEMBL8924793 0.71 EPHX1 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5610016-A REACTING A GLYOXAL DERIVATIVE, CHEMILUMINESCENCE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-03-11 US claimed
EP-0675360-A2 Method for measuring adenyl group containing substances using heteropoly acid MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-10-04 EP claimed
CN-117858874-A HPK1 degrading agents, compositions comprising the same, and methods of use thereof 百放开曼有限公司 2024-04-09 CN disclosed
US-5744307-A CHEMILUMINESCENCE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1998-04-28 US disclosed
US-5723473-A Propenoic acid derivatives useful as fungicides ZENECA LIMITED (GB) 1998-03-03 US disclosed
US-5610016-A REACTING A GLYOXAL DERIVATIVE, CHEMILUMINESCENCE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1997-03-11 US disclosed
EP-0675360-A2 Method for measuring adenyl group containing substances using heteropoly acid MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1995-10-04 EP disclosed
EP-0664795-A1 PROPENOIC ACID DERIVATIVES USEFUL AS FUNGICIDES ZENECA LIMITED (GB) 1995-08-02 EP disclosed
EP-0617283-A1 Method for measuring adenyl group-containing substances MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1994-09-28 EP disclosed
WO-1994008968-A1 PROPENOIC ACID DERIVATIVES USEFUL AS FUNGICIDES ZENECA LIMITED (GB) 1994-04-28 WO disclosed
US-4607126-A Process for the preparation of glyoxal, alkylglyoxals and acetals thereof CHEMIE LINZ AKTIENGESELLSCHAFT (AT) 1986-08-19 US disclosed