SCHEMBL4609539

SCHEMBL4609539

CCC[C](CC)CCC(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL9140167 0.85 CES1 (0.35) ALDH1A1
SCHEMBL1678094 0.80
SCHEMBL3971927 0.75 CES1 (0.35) ALDH1A1
SCHEMBL3280236 0.75
SCHEMBL497824 0.73
SCHEMBL2998926 0.69 CES1 (0.43) ALDH1A1
SCHEMBL1462669 0.68 CES2 (0.63) ALDH1A1
SCHEMBL10014775 0.68 CES2 (0.41) ALDH1A1
SCHEMBL22921037 0.68 ALDH1A1 (0.31) ALDH1A1
SCHEMBL18862371 0.68

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-2898012-A1 OXYGEN SCAVENGING PLASTIC MATERIAL Clariant Finance (BVI) Limited (VG) 2015-07-29 EP disclosed
WO-2014044366-A1 OXYGEN SCAVENGING PLASTIC MATERIAL CLARIANT INTERNATIONAL LTD (CH) 2014-03-27 WO disclosed
EP-1757612-B1 Tantalum- and Niobium- compounds and their use in Chemical Vapour deposition (CVD) STARCK H C GMBH (DE) 2008-10-08 EP disclosed
EP-1757612-A2 Tantal and Vanadium compounds and their use in Chemical Vapour deposition (CVD) H.C. Starck GmbH & Co. KG (DE) 2007-02-28 EP disclosed
EP-1253146-B1 Process for the synthesis of substituted furancarboxylates DSM FINE CHEM AUSTRIA GMBH (AT) 2003-09-10 EP disclosed
EP-1253146-A1 Process for the synthesis of substituted furancarboxylates DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) 2002-10-30 EP disclosed