SCHEMBL258448

SCHEMBL258448

CCCCCCC=CC(=O)NCC(C)C

nearest known ligand 0.80

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.80
CNR1 P21554 4/20 0.80
EPHX1 P07099 1/20 0.51
PPARG P37231 2/20 0.50
PPARD Q03181 2/20 0.50
PPARA Q07869 2/20 0.50

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
SCHEMBL258447 1.00 CNR2 (0.80) CNR2CNR1EPHX1PPARGPPARD
SCHEMBL5553149 1.00 CNR2 (0.80) CNR2CNR1EPHX1PPARGPPARD
SCHEMBL1946504 1.00 CNR2 (0.80) CNR2CNR1EPHX1PPARGPPARD
SCHEMBL20883258 1.00 CNR2 (0.80) CNR2CNR1EPHX1PPARGPPARD
SCHEMBL20883283 1.00 CNR2 (0.80) CNR2CNR1EPHX1PPARGPPARD
SCHEMBL5553152 1.00 CNR2 (0.80) CNR2CNR1EPHX1PPARGPPARD
SCHEMBL1030756 1.00 CNR2 (0.80) CNR2CNR1EPHX1PPARGPPARD
SCHEMBL4205215 0.95 CNR2 (0.73) CNR2CNR1PPARGPPARDPPARA
SCHEMBL29406024 0.90 CNR2 (0.66) CNR2CNR1PPARGPPARDPPARA
SCHEMBL2262688 0.89 CNR2 (1.00) CNR2CNR1PPARGPPARDPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1517880-B1 PRODUCTION OF CIS-PELLITORIN AND USE AS A FLAVOURING SYMRISE AG (DE) 2011-01-05 EP claimed
US-11937622-B2 Obtaining a volatile fraction from juices or alcoholic beverages SYMRISE AG (DE) 2024-03-26 US disclosed
US-20220117271-A1 OBTAINING A VOLATILE FRACTION FROM JUICES OR ALCOHOLIC BEVERAGES SYMRISE AG (DE) 2022-04-21 US disclosed
EP-3836799-A1 OBTAINING A VOLATILE FRACTION FROM JUICES OR ALCOHOLIC BEVERAGES Symrise AG (DE) 2021-06-23 EP disclosed
CN-112566507-A Obtaining volatile fraction from fruit and vegetable juice or alcoholic beverage 西姆莱斯有限公司 2021-03-26 CN disclosed
WO-2020035147-A1 OBTAINING A VOLATILE FRACTION FROM JUICES OR ALCOHOLIC BEVERAGES SYMRISE AG (DE) 2020-02-20 WO disclosed
EP-2158894-B1 Oral cleansing agent HENKEL AG & CO KGAA (DE) 2018-11-07 EP disclosed
EP-2140853-B1 Coated particle for use in cosmetics HENKEL AG & CO KGAA (DE) 2018-07-18 EP disclosed
US-9987217-B2 Blackberry extract SYMRISE AG (DE) 2018-06-05 US disclosed
EP-2347754-B1 Oral and tooth care and cleaning agents with alkylpyridinium salts I HENKEL AG & CO KGAA (DE) 2018-01-24 EP disclosed
WO-2004043906-A2 USE OF TRANS-PELLITORIN IN THE FORM OF AN AROMATIC SUBSTANCE SYMRISE GMBH & CO. KG (DE) 2004-05-27 WO disclosed
WO-2004015044-A1 CARVONE ACETALS USED AS FLAVOURINGS SYMRISE GMBH & CO. KG (DE) 2004-02-19 WO disclosed
US-6673756-B2 MULTILAYER; CUTTING, JOINING UNDER PRESSURE SYMRISE GMBH & CO. KG (DE) 2004-01-06 US disclosed
WO-2004000787-A2 PRODUCTION OF CIS-PELLITORIN AND USE AS A FLAVOURING SYMRISE GMBH & CO. KG (DE) 2003-12-31 WO disclosed
WO-2003106404-A1 USE OF ALKYLAMIDOMANDELATES AS FLAVOURINGS SYMRISE GMBH & CO. KG (DE) 2003-12-24 WO disclosed
US-20030152682-A1 Use of ferulic acid amides as flavor compounds SYMRISE AG (DE) 2003-08-14 US disclosed
EP-1326955-A1 MULTI-PHASE SOAP HAARMANN & REIMER GMBH (DE) 2003-07-16 EP disclosed
EP-1323356-A2 Use of ferulic amides as flavouring agents HAARMANN & REIMER GMBH (DE) 2003-07-02 EP disclosed
US-20020173436-A1 Multilayer; cutting, joining under pressure SYMRISE GMBH & CO. KG (DE) 2002-11-21 US disclosed
WO-2002024857-A1 MULTI-PHASE SOAP HAARMANN & REIMER GMBH (DE) 2002-03-28 WO disclosed