SCHEMBL5187656

SCHEMBL5187656

C=CCC1(OC(=O)O)C=CCC=C1

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
SCHEMBL1044737 0.72
SCHEMBL8368917 0.70
SCHEMBL5185822 0.65 CYP3A4 (0.31)
SCHEMBL11077940 0.64 MEN1 (0.31)
SCHEMBL11077931 0.64 MEN1 (0.31)
SCHEMBL9752476 0.63 ABCC4 (0.30)
SCHEMBL10448620 0.63 MEN1 (0.38)
SCHEMBL9804568 0.63
SCHEMBL5186920 0.62
SCHEMBL9619503 0.61

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
EP-1569965-B1 METHOD FOR RADICAL POLYMERISATION IN THE PRESENCE OF A CHAIN TRANSFER AGENT BASF AG (DE) 2007-07-11 EP claimed
EP-1569965-A2 METHOD FOR RADICAL POLYMERISATION IN THE PRESENCE OF A CHAIN TRANSFER AGENT BASF AKTIENGESELLSCHAFT (DE) 2005-09-07 EP claimed
WO-2004050717-A2 METHOD FOR RADICAL POLYMERISATION IN THE PRESENCE OF A CHAIN TRANSFER AGENT BASF AKTIENGESELLSCHAFT (DE) 2004-06-17 WO claimed
EP-1569965-B1 METHOD FOR RADICAL POLYMERISATION IN THE PRESENCE OF A CHAIN TRANSFER AGENT BASF AG (DE) 2007-07-11 EP disclosed
EP-1569965-A2 METHOD FOR RADICAL POLYMERISATION IN THE PRESENCE OF A CHAIN TRANSFER AGENT BASF AKTIENGESELLSCHAFT (DE) 2005-09-07 EP disclosed
WO-2004050717-A2 METHOD FOR RADICAL POLYMERISATION IN THE PRESENCE OF A CHAIN TRANSFER AGENT BASF AKTIENGESELLSCHAFT (DE) 2004-06-17 WO disclosed