SCHEMBL6566613

SCHEMBL6566613

CC(C)=C(C)C[S+]([O-])c1ccc(C)cc1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL24844520 0.82 CYP19A1 (0.32) ACHETDP1
SCHEMBL254515 0.80 ALDH1A1 (0.37) TDP1
SCHEMBL30929941 0.76 KMT2A (0.41)
SCHEMBL9456923 0.76 KMT2A (0.41)
SCHEMBL9456919 0.76 KMT2A (0.41)
SCHEMBL9457024 0.76 KMT2A (0.41)
SCHEMBL3233200 0.74 CA2 (0.36) ACHE
SCHEMBL20906472 0.73 ACHE (0.42) ACHETDP1
SCHEMBL20921311 0.73 ACHE (0.42) ACHETDP1
SCHEMBL9843698 0.72 ALDH1A1 (0.33) ACHETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2673244-B1 PROCESS FOR THE OXIDATION OF MESITOL BASF SE (DE) 2017-09-27 EP disclosed
CN-103402950-B Method for oxidizing star phenol BASF SE (DE) 2016-11-30 CN disclosed
US-8957260-B2 Process for the oxidation of mesitol BASF SE (DE) 2015-02-17 US disclosed
EP-2673244-A1 PROCESS FOR THE OXIDATION OF MESITOL BASF SE (DE) 2013-12-18 EP disclosed
CN-103402950-A Method for oxidizing star phenol BASF SE 2013-11-20 CN disclosed
WO-2012107877-A1 PROCESS FOR THE OXIDATION OF MESITOL BASF SE (DE) 2012-08-16 WO disclosed
US-20120203013-A1 PROCESS FOR THE OXIDATION OF MESITOL BASF SE (DE) 2012-08-09 US disclosed
US-20040220416-A1 Process for the singlet oxygen oxidation of organic substrates DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO (AT) 2004-11-04 US disclosed
US-20040166052-A1 Process for generating singlet oxygen and use thereof DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) 2004-08-26 US disclosed
EP-1447379-A2 Process for generating singulet oxygen and use thereof DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) 2004-08-18 EP disclosed
EP-1447378-A1 Singlet oxygen production from Sn(II) salt and ozone DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) 2004-08-18 EP disclosed
US-20040156776-A1 Singlet oxygen oxidation of organic substrates DSM FINE CHEMICALS AUSTRIA NFG GMBH & CO KG (AT) 2004-08-12 US disclosed
EP-1173396-B1 SINGLET OXYGEN OXIDATION OF ORGANIC SUBSTRATES DSM FINE CHEM AUSTRIA GMBH (AT) 2004-05-19 EP disclosed
EP-1403234-A2 Process for singlet oxygen oxidation of organic substrates DSM Fine Chemicals Austria Nfg GmbH & Co KG (AT) 2004-03-31 EP disclosed
EP-1169281-B1 SINGLET OXYGEN OXIDATION OF ORGANIC SUBSTRATES DSM FINE CHEM AUSTRIA GMBH (AT) 2004-02-18 EP disclosed
EP-1173396-A1 SINGLET OXYGEN OXIDATION OF ORGANIC SUBSTRATES DSM Fine Chemicals Austria GmbH (AT) 2002-01-23 EP disclosed
EP-1169281-A1 SINGLET OXYGEN OXIDATION OF ORGANIC SUBSTRATES DSM Fine Chemicals Austria GmbH (AT) 2002-01-09 EP disclosed
WO-2000064842-A1 SINGLET OXYGEN OXIDATION OF ORGANIC SUBSTRATES DSM FINE CHEMICALS AUSTRIA GMBH (AT) 2000-11-02 WO disclosed
WO-2000061524-A1 SINGLET OXYGEN OXIDATION OF ORGANIC SUBSTRATES DSM FINE CHEMICALS AUSTRIA GMBH (AT) 2000-10-19 WO disclosed