SCHEMBL4185614

SCHEMBL4185614

C=CC(C)(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
SCHEMBL9812214 0.78
SCHEMBL134231 0.71
SCHEMBL8649763 0.71
SCHEMBL14284321 0.69
SCHEMBL5084447 0.69
SCHEMBL5084442 0.69
SCHEMBL1285597 0.67 TSHR (0.50)
SCHEMBL3096498 0.67
SCHEMBL14700073 0.67 ALDH1A1 (0.33)
SCHEMBL222499 0.67

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1069299-C Process for producing all trans-form polyprenols KURARAY CO (JP) 2001-08-08 CN claimed
CN-1153763-A Process for producing all trans-form polyprenols KURARAY CO (JP) 1997-07-09 CN claimed
CN-107735411-A Water soluble emulsion composite 株式会社可乐丽 2018-02-23 CN disclosed
US-20090186868-A1 Taxane Compound Having Azetidine Ring Structure DAIICHI SANKYO COMPANY LIMITED (JP) 2009-07-23 US disclosed
EP-1942109-A1 TAXANE COMPOUND WITH AZETIDINE RING STRUCTURE Daiichi Sankyo Company, Limited (JP) 2008-07-09 EP disclosed
US-7323520-B2 Anti-aging agents for rubber vulcanizates based on organic compounds containing conjugated azadienes LANXESS DEUTSCHLAND GMBH (DE) 2008-01-29 US disclosed
EP-1415980-B1 Anti-aging agent for rubber vulcanisates LANXESS DEUTSCHLAND GMBH (DE) 2006-10-04 EP disclosed
US-20040087722-A1 Anti-aging agents for rubber vulcanizates based on organic compounds containing conjugated azadienes LANXESS DEUTSCHLAND GMBH (DE) 2004-05-06 US disclosed
EP-1415980-A1 Anti-aging agent for rubber vulcanisates Bayer Aktiengesellschaft (DE) 2004-05-06 EP disclosed
CN-1069299-C Process for producing all trans-form polyprenols KURARAY CO (JP) 2001-08-08 CN disclosed
CN-1153763-A Process for producing all trans-form polyprenols KURARAY CO (JP) 1997-07-09 CN disclosed
CN-1066840-A PROCESS OF LINEAR DICARBONYLATION FOR DIFUNDTIONALIZED BUTENE RHONE POULENC CHIMIE (FR) 1992-12-09 CN disclosed
US-4180646-A BIOERODABLE SUSTAINED RELEASE COTAINGS ALZA CORPORATION (US) 1979-12-25 US disclosed
US-4138344-A Erodible agent releasing device comprising poly(orthoesters) and poly(orthocarbonates) ALZA CORPORATION (US) 1979-02-06 US disclosed
US-4131648-A POLYMERIC MATERIALS ALZA CORPORATION (US) 1978-12-26 US disclosed
US-4093709-A Drug delivery devices manufactured from poly(orthoesters) and poly(orthocarbonates) ALZA CORPORATION (US) 1978-06-06 US disclosed
US-4026907-A INTERMEDIATES FOR ALPHA-TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-05-31 US disclosed
US-4018799-A INTERMEDIATES FOR TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-04-19 US disclosed
US-4003919-A INTERMEDIATES FOR ALPHA-TOCOPHEROL HOFFMANN-LA ROCHE INC. (US) 1977-01-18 US disclosed
US-3947473-A (6-HYDROXY-CHROMAN-2-YL) CARBOXYLIC ACID DERIVATIVES HOFFMAN-LA ROCHE INC. (US) 1976-03-30 US disclosed