SCHEMBL76399

SCHEMBL76399

COC(OC)(OC)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TSHR P16473 3/20 0.39
TP53 P04637 1/20 0.33
FFAR3 O14843 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30
CES1 P23141 1/20 0.30

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
SCHEMBL2162997 0.78 ALDH1A1 (0.32) ALDH1A1TSHRFFAR3
SCHEMBL223597 0.78 ALDH1A1 (0.32) ALDH1A1FFAR3
SCHEMBL14086596 0.71 ALDH1A1 (0.41) ALDH1A1TSHRFFAR3LCKFYN
SCHEMBL170211 0.71 ALDH1A1 (0.39) ALDH1A1TSHRTP53FFAR3LCK
SCHEMBL9416833 0.71 ALDH1A1 (0.47) ALDH1A1TSHRTP53FFAR3LCK
SCHEMBL11578519 0.71 ALDH1A1 (0.39) ALDH1A1TSHRTP53FFAR3LCK
SCHEMBL11765862 0.69 PEPD (0.33) ALDH1A1
SCHEMBL7196075 0.69
SCHEMBL788497 0.69 DGAT1 (0.42) ALDH1A1TSHR
SCHEMBL20641576 0.69 LMNA (0.35) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2831253-B1 ENZYMES USEFUL FOR PERACID PRODUCTION DUPONT US HOLDING LLC (US) 2021-11-24 EP claimed
CN-104988187-B Production of peracids using enzymes having perhydrolytic activity 纳幕尔杜邦公司 2021-02-05 CN claimed
EP-2471941-B1 Production of peracids using an enzyme having perhydrolysis activity DU PONT (US) 2015-09-02 EP claimed
EP-2342324-B1 ENZYMATIC PERACID PRODUCTION USING A COSOLVENT DU PONT (US) 2015-03-04 EP claimed
US-8962294-B2 Perhydrolase variant providing improved specific activity E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-02-24 US claimed
US-8956843-B2 Perhydrolase variant providing improved specific activity E. I. DU PONT DE NEMOURS AND COMPANY (US) 2015-02-17 US claimed
EP-2831251-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 EP claimed
EP-2831226-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 EP claimed
EP-2831252-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 EP claimed
EP-2831250-A1 ENZYMES USEFUL FOR PERACID PRODUCTION E. I. Du Pont de Nemours and Company (US) 2015-02-04 EP claimed
EP-1877566-A1 ENZYMATIC PRODUCTION OF PERACIDS USING PERHYDROLYTIC ENZYMES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2008-01-16 EP claimed
US-20070184999-A1 Enzymatic production of peracids using lactobacilli having perhydrolysis activity E. I. DU PONT DE NEMOURS AND COMPANY 2007-08-09 US claimed
WO-2007070609-A2 PRODUCTION OF PERACIDS USING AN ENZYME HAVING PERHYDROLYSIS ACTIVITY E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-06-21 WO claimed
US-20070105740-A1 Enzymatic production of peracids using perhydrolytic enzymes DUPONT US HOLDING, LLC 2007-05-10 US claimed
WO-2007044667-A1 ENZYMATIC PRODUCTION OF PERACIDS FROM CARBOXYLIC ACID ESTER SUBSTRATES USING NON-HEME HALOPEROXIDASES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-04-19 WO claimed
WO-2007044666-A2 ENZYMATIC PRODUCTION OF PERACIDS USING LACTOBACILLI HAVING PERHYDROLYSIS ACTIVITY E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-04-19 WO claimed
US-20070082832-A1 Enzymatic production of peracids from carboxylic acid ester substrates using non-heme haloperoxidases E. I. DU PONT DE NEMOURS AND COMPANY 2007-04-12 US claimed
US-20070042924-A1 Enzymatic production of peracids using perhydrolytic enzymes DUPONT US HOLDING, LLC 2007-02-22 US claimed
WO-2006119060-A1 ENZYMATIC PRODUCTION OF PERACIDS USING PERHYDROLYTIC ENZYMES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2006-11-09 WO claimed
US-4268651-A Two-phase vinyl chloride polymerization RHONE-POULENC INDUSTRIES (FR) 1981-05-19 US claimed