SCHEMBL2579873

SCHEMBL2579873

CC(=CO)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
SCHEMBL246006 0.74
SCHEMBL2173976 0.74
SCHEMBL487578 0.74
SCHEMBL2173973 0.74
SCHEMBL12341651 0.74
SCHEMBL246005 0.74
SCHEMBL8302855 0.71
SCHEMBL28201803 0.71 PTGS1 (0.40)
SCHEMBL34404 0.71
SCHEMBL149416 0.71

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
US-8048979-B2 Process for synthesis of telechelic urethane acrylate UV curable pre-polymeric materials COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2011-11-01 US disclosed
US-20090306240-A1 PROCESS FOR SYNTHESIS OF TELECHELIC URETHANE ACRYLATE UV CURABLE PRE-POLYMERIC MATERIALS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2009-12-10 US disclosed
WO-2007077564-A1 PROCESS FOR SYNTHESIS OF TELECHELIC URETHANE ACRYLATE UV CURABLE PRE-POLYMERIC MATERIALS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2007-07-12 WO disclosed
US-5266714-A Esterification of epoxidized oils HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1993-11-30 US disclosed
US-4543404-A ACRYLATED POLYURETHANE AND AMINO ALKOXYSILANE NEGAMI CHEMICAL INDUSTRIAL CO., LTD. (JP) 1985-09-24 US disclosed
EP-0142228-A1 Polycarbonate-modified urethane acrylate adhesive NEGAMI CHEMICAL INDUSTRIAL CO LTD (JP) 1985-05-22 EP disclosed
EP-0136074-A2 Primer composition NEGAMI CHEMICAL INDUSTRIAL CO LTD (JP) 1985-04-03 EP disclosed