SCHEMBL9013790

SCHEMBL9013790

[2H]C([2H])([2H])OC(=O)C(=C)C

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
SCHEMBL17658972 0.86
SCHEMBL27466495 0.79 ALDH1A1 (1.00)
SCHEMBL4390490 0.79 ALDH1A1 (1.00)
SCHEMBL10636466 0.79
SCHEMBL1849 0.79
SCHEMBL1330593 0.77
Hydrogen Peroxide SCHEMBL9143793 0.77
SCHEMBL21340366 0.77
SCHEMBL20681605 0.77
Fluoride SCHEMBL5607591 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015026370-A1 CROSS-LINKED CO-POLYMERS FOR MAKING OPTOELECTRONIC DEVICES EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2015-02-26 WO claimed
US-20160200845-A1 CROSS-LINKED CO-POLYMERS FOR MAKING OPTOELECTRONIC DEVICES EMPIRE TECHNOLOGY DEV LLC (US) 2016-07-14 US disclosed
WO-2015026370-A1 CROSS-LINKED CO-POLYMERS FOR MAKING OPTOELECTRONIC DEVICES EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2015-02-26 WO disclosed
EP-0420592-B1 Planar plastics optical waveguide NIPPON TELEGRAPH & TELEPHONE (JP) 1996-12-11 EP disclosed
EP-0658782-A2 Plate plastics optical waveguide NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1995-06-21 EP disclosed
EP-0658783-A2 Plate plastics optical waveguide NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1995-06-21 EP disclosed
US-5062680-A Upper and lower polymeric clad portions, core portion of polymer of deuterated or halogenated acrylates or siloxanes NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1991-11-05 US disclosed
EP-0420592-A2 Planar plastics optical waveguide NIPPON TELEGRAPH AND TELEPHONE CORPORATION (JP) 1991-04-03 EP disclosed