SCHEMBL45545

SCHEMBL45545

C=CCC1(CC=CO)COCOC1

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
SCHEMBL860534 0.92
SCHEMBL5439874 0.90
SCHEMBL2044521 0.85
SCHEMBL862034 0.81 EPHX1 (0.35)
SCHEMBL2048752 0.81
SCHEMBL2048753 0.81
SCHEMBL2045149 0.79
SCHEMBL2045146 0.79
SCHEMBL7133540 0.79 GABRR1 (0.31)
SCHEMBL8943350 0.78 EPHX1 (0.34)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1606230-B1 PROCESS FOR MANUFACTURE OF AN ALLYL ETHER PERSTORP SPECIALTY CHEM AB (SE) 2012-09-19 EP claimed
EP-1468040-B1 CHAIN EXTENDED DENDRITIC POLYETHER PERSTORP SPECIALTY CHEM AB (SE) 2012-06-13 EP claimed
WO-2012005648-A1 UNSATURATED OLIGIO OR POLYESTER PERSTORP AB (SE) 2012-01-12 WO claimed
JP-4800201-B2 2011-10-26 JP claimed
US-7091308-B2 Chain extended dendritic polyether PERSTORP SPECIALTY CHEMICALS AB (SE) 2006-08-15 US claimed
US-20060116534-A1 Process for manufacture of an allyl ether PERSTORP SPECIALTY CHEMICALS AB (SE) 2006-06-01 US claimed
CN-1777568-A Process for manufacture of an allyl ether PERSTORP SPECIALTY CHEM AB (SE) 2006-05-24 CN claimed
EP-1606230-A1 PROCESS FOR MANUFACTURE OF AN ALLYL ETHER Perstorp Specialty Chemicals AB (SE) 2005-12-21 EP claimed
US-20050131205-A1 For use in preparation of air drying allyd resins, 1-and 2-component polyurethane coatings and adhesives, saturated and unsaturated polyesters, toughening agents for thermosetting resins, such as epoxy resins, unsaturated polyester, vinyl esters, polyurethanes, maleimides PERSTORP SPECIALTY CHEMICALS AB (SE) 2005-06-16 US claimed
EP-1468040-A1 CHAIN EXTENDED DENDRITIC POLYETHER Perstorp Specialty Chemicals AB (SE) 2004-10-20 EP claimed
WO-2004083153-A1 PROCESS FOR MANUFACTURE OF AN ALLYL ETHER PERSTORP SPECIALTY CHEMICALS AB (SE) 2004-09-30 WO claimed
WO-2003062306-A1 CHAIN EXTENDED DENDRITIC POLYETHER PERSTORP SPECIALTY CHEMICALS AB (SE) 2003-07-31 WO claimed
WO-2003062297-A1 POLYURETHANE FOAM COMPOSITION COMPRISING CHAIN EXTENDED DENDRITIC POLYETHER PERSTORP SPECIALTY CHEMICALS AB (SE) 2003-07-31 WO claimed
WO-2003046048-A1 PROCESS FOR ALKYLATION OF AN ALKOXYLATED MONO DI, TRI OR POLYHYDRIC COMPOUND PERSTORP SPECIALTY CHEMICALS AB (SE) 2003-06-05 WO claimed
EP-1027303-B1 SHRINKAGE-REDUCING AGENT FOR CEMENT COMPOSITIONS PERSTORP AB (SE) 2002-11-27 EP claimed
US-6251180-B1 ADDITIVE COMPRISING AT LEAST ONE CYCLIC ACETAL OF A TRI OR POLYHYDRIC ALCOHOL, SAID CYCLIC ACETAL HAVING AT LEAST ONE 1, 3-DIOXA GROUP, AND OPTIONALLY AT LEAST ONE SILICA. PERSTORP AB (SE) 2001-06-26 US claimed
WO-2000064975-A1 PROCESS FOR PRODUCTION OF AN ACRYLATE COMPOSITION PERSTORP AB (SE) 2000-11-02 WO claimed
WO-2000031012-A1 PROCESS FOR PRODUCTION OF AN ALLYLOXY CARBOXYLIC ACID PERSTORP AB (SE) 2000-06-02 WO claimed
EP-2591040-B1 ALKYD RESIN PERSTORP AB (SE) 2019-08-14 EP disclosed
WO-2000031012-A1 PROCESS FOR PRODUCTION OF AN ALLYLOXY CARBOXYLIC ACID PERSTORP AB (SE) 2000-06-02 WO disclosed