SCHEMBL3944987

SCHEMBL3944987

C=C1C(=O)OC[C@@H]1C

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
SCHEMBL2376391 1.00
SCHEMBL3947301 1.00
SCHEMBL12121169 0.76
SCHEMBL8398637 0.76
SCHEMBL6702328 0.74
(+/-)-Tulipaline B SCHEMBL4922801 0.70
(+/-)-Tulipaline B SCHEMBL1073177 0.70
(+/-)-Tulipaline B SCHEMBL4926880 0.70
SCHEMBL1801718 0.70
SCHEMBL8398130 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9309332-B2 Polymerization catalysts, methods and products COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2016-04-12 US disclosed
US-20140058041-A1 POLYMERIZATION CATALYSTS, METHODS AND PRODUCTS COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2014-02-27 US disclosed
US-7512309-B2 Polymer composition, plastic optical fiber, plastic optical fiber cable, and method for manufacturing plastic optical fiber MITSUBISHI RAYON CO, LTD. (JP) 2009-03-31 US disclosed
US-20080166091-A1 Polymer Composition, Plastic Optical Fiber, Plastic Optical Fiber Cable, and Method for Manufacturing Plastic Optical Fiber MITSUBISHI RAYON CO., LTD. (JP) 2008-07-10 US disclosed
CN-101087820-A Polymer composition, plastic optical fiber, plastic optical cable, and method for producing plastic optical fiber MITSUBISHI RAYON CO (JP) 2007-12-12 CN disclosed
EP-1834968-A1 POLYMER COMPOSITION, PLASTIC OPTICAL FIBER, PLASTIC OPTICAL FIBER CABLE AND METHOD FOR PRODUCING PLASTIC OPTICAL FIBER Mitsubishi Rayon Co., Ltd. (JP) 2007-09-19 EP disclosed