SCHEMBL1964357

SCHEMBL1964357

C=CC(CCCCC(C)C)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 1/20 0.44
KDM4C Q9H3R0 2/20 0.36
KDM4A O75164 1/20 0.36
PHF8 Q9UPP1 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.35
CYP3A4 P08684 1/20 0.35
ALOX15 P16050 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM1A O60341 1/20 0.35
ALDH1A1 P00352 1/20 0.33
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
RARB P10826 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GPR84 Q9NQS5 2/20 0.32
LTA4H P09960 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
SCHEMBL322762 0.98 BLM (0.42) BLMKDM4CKDM4APHF8KDM2A
SCHEMBL724139 0.98 BLM (0.42) BLMKDM4CKDM4APHF8KDM2A
SCHEMBL12096982 0.98 BLM (0.42) BLMKDM4CKDM4APHF8KDM2A
SCHEMBL5158569 0.96 BLM (0.48) BLMKDM4CKDM4APHF8KDM2A
SCHEMBL8011909 0.87 SLC1A3 (0.39) BLMMEN1KMT2ASLC1A3SLC1A2
SCHEMBL4452846 0.87 GPR84 (0.37) BLMMEN1KMT2AACE2GPR84
SCHEMBL8770471 0.85 LMNA (0.37) BLMKDM4CKDM4APHF8KDM2A
SCHEMBL715220 0.83 GPR84 (0.50) ALDH1A1SLC1A2SLC1A1ACE2GPR84
SCHEMBL302569 0.82 GPR84 (0.53) BLMALDH1A1SLC1A2SLC1A1ACE2
SCHEMBL743054 0.82 GPR84 (0.53) BLMALDH1A1SLC1A2SLC1A1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2872466-B1 METHOD FOR PRODUCING ISONONANOIC ACIDS FROM 2-ETHYL HEXANOL OXEA GMBH (DE) 2017-11-01 EP claimed
EP-2872466-A1 METHOD FOR PRODUCING ISONONANOIC ACIDS FROM 2-ETHYL HEXANOL OXEA GmbH (DE) 2015-05-20 EP claimed
WO-2014191090-A1 MIXTURES CONTAINING TERTIARY ISONONANOIC ACIDS, STARTING FROM 2-ETHYLHEXANOL, METHOD FOR THE PRODUCTION THEREOF AND THE PRODUCTION OF SECONDARY PRODUCTS OXEA GMBH (DE) 2014-12-04 WO claimed
WO-2014008975-A1 METHOD FOR PRODUCING ISONONANOIC ACIDS FROM 2-ETHYL HEXANOL OXEA GMBH (DE) 2014-01-16 WO claimed
EP-0277038-B1 Multi-color transfer image forming method KONISHIROKU PHOTO IND (JP) 1994-11-23 EP claimed
EP-3186218-B1 METHOD FOR THE PRODUCTION OF MIXTURES CONTAINING TERTIARY ISONONANOIC ACIDS BASED ON 2-ETHYLHEXANOL OXEA GMBH (DE) 2018-10-24 EP disclosed
EP-2872466-B1 METHOD FOR PRODUCING ISONONANOIC ACIDS FROM 2-ETHYL HEXANOL OXEA GMBH (DE) 2017-11-01 EP disclosed
EP-3186218-A1 METHOD FOR THE PRODUCTION OF MIXTURES CONTAINING TERTIARY ISONONANOIC ACIDS BASED ON 2-ETHYLHEXANOL OXEA GmbH (DE) 2017-07-05 EP disclosed
EP-2509574-B1 POLYMER COMBINATION FOR A SHINE-PRODUCING COSMETIC HAIR TREATMENT AGENT HAVING STRONG HOLD AND GOOD HAIR FEEL HENKEL AG & CO KGAA (DE) 2017-01-18 EP disclosed
EP-2872478-B1 VINYL ESTERS OF ISONONANOIC ACID STARTING FROM 2-ETHYL HEXANOL, METHODS FOR THE PRODUCTION THEREOF AND USE THEREOF OXEA GMBH (DE) 2016-12-07 EP disclosed
WO-2016029978-A1 METHOD FOR THE PRODUCTION OF MIXTURES CONTAINING TERTIARY ISONONANOIC ACIDS BASED ON 2-ETHYLHEXANOL OXEA GMBH (DE) 2016-03-03 WO disclosed
EP-2872478-A1 VINYL ESTERS OF ISONONANOIC ACID STARTING FROM 2-ETHYL HEXANOL, METHODS FOR THE PRODUCTION THEREOF AND USE THEREOF OXEA GmbH (DE) 2015-05-20 EP disclosed
WO-2014191090-A1 MIXTURES CONTAINING TERTIARY ISONONANOIC ACIDS, STARTING FROM 2-ETHYLHEXANOL, METHOD FOR THE PRODUCTION THEREOF AND THE PRODUCTION OF SECONDARY PRODUCTS OXEA GMBH (DE) 2014-12-04 WO disclosed
WO-2014191090-A1 MIXTURES CONTAINING TERTIARY ISONONANOIC ACIDS, STARTING FROM 2-ETHYLHEXANOL, METHOD FOR THE PRODUCTION THEREOF AND THE PRODUCTION OF SECONDARY PRODUCTS OXEA GMBH (DE) 2014-12-04 WO disclosed
WO-2014008977-A1 VINYL ESTERS OF ISONONANOIC ACID STARTING FROM 2-ETHYL HEXANOL, METHODS FOR THE PRODUCTION THEREOF AND USE THEREOF OXEA GMBH (DE) 2014-01-16 WO disclosed
WO-2014008975-A1 METHOD FOR PRODUCING ISONONANOIC ACIDS FROM 2-ETHYL HEXANOL OXEA GMBH (DE) 2014-01-16 WO disclosed
WO-2014008975-A1 METHOD FOR PRODUCING ISONONANOIC ACIDS FROM 2-ETHYL HEXANOL OXEA GMBH (DE) 2014-01-16 WO disclosed
WO-2014005842-A1 METHOD FOR THE PRODUCTION OF VINYL ISONONANOATES OXEA GMBH (DE) 2014-01-09 WO disclosed
EP-2509574-A2 POLYMER COMBINATION FOR A SHINE-PRODUCING COSMETIC HAIR TREATMENT AGENT HAVING STRONG HOLD AND GOOD HAIR FEEL Henkel AG & Co. KGaA (DE) 2012-10-17 EP disclosed
WO-2011069786-A2 POLYMER COMBINATION FOR A SHINE-PRODUCING COSMETIC HAIR TREATMENT AGENT HAVING STRONG HOLD AND GOOD HAIR FEEL HENKEL AG & CO. KGAA (DE) 2011-06-16 WO disclosed