SCHEMBL539072

SCHEMBL539072

CCCCCCC=COC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.50
TRPV1 Q8NER1 1/20 0.50
TSHR P16473 2/20 0.44
TERT O14746 3/20 0.43
CYP1A2 P05177 2/20 0.43
MAPT P10636 2/20 0.43
CYP2C19 P33261 2/20 0.43
BLM P54132 2/20 0.43
HSD17B10 Q99714 2/20 0.43
FABP4 P15090 2/20 0.43
PTPN1 P18031 2/20 0.43
PPARG P37231 2/20 0.43
KMT2A Q03164 2/20 0.43
PPARD Q03181 2/20 0.43
PPARA Q07869 2/20 0.43
GMNN O75496 1/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
CYP2C9 P11712 1/20 0.43

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
SCHEMBL1723664 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL1723661 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL18339650 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL1142198 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL1617870 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL539071 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL1617871 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL16588401 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL21995855 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2
SCHEMBL385959 1.00 FAAH (0.50) FAAHTRPV1TSHRTERTCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0217581-A1 Carboxylate salt compound and method for flavouring foodstuffs and tobacco HERCULES INCORPORATED (US) 1987-04-08 EP claimed
EP-2285488-B1 METHOD FOR PRODUCING SATURATED ETHERS BY HYDROGENATION OF UNSATURATED ETHERS EVONIK OXENO GMBH (DE) 2012-02-08 EP disclosed
EP-2285488-A1 CATALYST AND METHOD FOR PRODUCING SATURATED ETHERS BY HYDROGENATION OF UNSATURATED ETHERS Evonik Oxeno GmbH (DE) 2011-02-23 EP disclosed
US-20110034739-A1 CATALYST AND PROCESS FOR PREPARING SATURATED ETHERS BY HYDROGENATING UNSATURATED ETHERS EVONIK OXENO GMBH (DE) 2011-02-10 US disclosed
WO-2009149996-A1 CATALYST AND METHOD FOR PRODUCING SATURATED ETHERS BY HYDROGENATION OF UNSATURATED ETHERS EVONIK OXENO GMBH (DE) 2009-12-17 WO disclosed
US-20070027058-A1 Process for producing detergent molecules comprising an ether linkage from butadiene EDWARDS CHARLES L 2007-02-01 US disclosed
US-20070021318-A1 Process for producing detergent molecules comprising an ether linkage from butadiene EDWARDS CHARLES L 2007-01-25 US disclosed
US-7141539-B2 Process for producing detergent molecules comprising an ether linkage from butadiene SHELL OIL COMPANY (US) 2006-11-28 US disclosed
WO-2005019138-A2 PROCESS FOR PRODUCING DETERGENT MOLECULES COMPRISING AN ETHER LINKAGE FROM BUTADIENE SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2005-03-03 WO disclosed
US-20050037940-A1 Process for producing detergent molecules comprising an ether linkage from butadiene SHELL OIL COMPANY 2005-02-17 US disclosed
EP-0872484-A1 ORGANOSILICON COMPOUNDS, LIQUID-CRYSTAL COMPOSITION, AND LIQUID-CRYSTAL DISPLAY ELEMENT CHISSO CORPORATION (JP) 1998-10-21 EP disclosed
WO-1998041494-A1 METHOD FOR PRODUCING N-BUTYRALDEHYDE AND/OR N-BUTANOL BASF AKTIENGESELLSCHAFT (DE) 1998-09-24 WO disclosed
US-5767325-A Preparation of enol ethers BASF AKTIENGESELLSCHAFT (DE) 1998-06-16 US disclosed
EP-0776879-A1 Process for the preparation of enol ethers BASF AKTIENGESELLSCHAFT (DE) 1997-06-04 EP disclosed
US-5079023-A During consumption; beverages HERCULES INCORPORATED (US) 1992-01-07 US disclosed
US-4891451-A CATALYTIC ELIMINATION OF ALCOHOL FROM ACETAL OF KETAL BASF AKTIENGESELLSCHAFT (DE) 1990-01-02 US disclosed
EP-0299286-A1 Process for the preparation of vinyl ethers BASF Aktiengesellschaft (DE) 1989-01-18 EP disclosed
US-4781762-A ALDEHYDE-RELEASING HERCULES INCORPORATED (US) 1988-11-01 US disclosed
US-4697025-A ETHERS WHICH DECOMPOSE TO ALDEHYDES HERCULES INCORPORATED (US) 1987-09-29 US disclosed
EP-0217581-A1 Carboxylate salt compound and method for flavouring foodstuffs and tobacco HERCULES INCORPORATED (US) 1987-04-08 EP disclosed