Dodecanoate

Dodecanoate

SCHEMBL4587316

CCCCCCCCCCCC(=O)[O-].c1ccc([S+](c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.54
CES1 P23141 2/20 0.54
FABP3 P05413 7/20 0.50
PPARG P37231 1/20 0.48
CA1 P00915 1/20 0.47
EPHX2 P34913 1/20 0.46

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
Stearic Acid SCHEMBL109141 1.00 CES2 (0.54) CES2CES1FABP3PPARGCA1
Heptanoate SCHEMBL107320 1.00 CES2 (0.54) CES2CES1FABP3PPARGCA1
Decanoic Acid SCHEMBL109283 1.00 CES2 (0.54) CES2CES1FABP3PPARGCA1
Nonanoate SCHEMBL105905 1.00 CES2 (0.54) CES2CES1FABP3PPARGCA1
Octanoic Acid SCHEMBL106093 1.00 CES2 (0.54) CES2CES1FABP3PPARGCA1
Hexanoate SCHEMBL105634 0.98 CES2 (0.53) CES2CES1FABP3PPARGCA1
Valeric Acid SCHEMBL106459 0.93 CA1 (0.55) CES2CES1FABP3PPARGCA1
Oleic Acid SCHEMBL106502 0.91 FABP3 (0.67) FABP3PPARGEPHX2
Oleic Acid SCHEMBL106504 0.91 FABP3 (0.67) FABP3PPARGEPHX2
Adipic Acid SCHEMBL108681 0.89 HDAC1 (0.55) CES2CES1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509814-A4 ACETAL PROTECTED POLYMERS AND PHOTORESISTS COMPOSITIONS THEREOF FUJIFILM ELECTRONIC MATERIALS (US) 2008-08-27 EP disclosed
EP-1656590-A2 NOVEL PHOTOSENSITIVE BILAYER COMPOSITION FujiFilm Electronic Materials USA, Inc. (US) 2006-05-17 EP disclosed
US-6929897-B2 Photosensitive bilayer composition ARCH SPECIALTY CHEMICALS, INC. (US) 2005-08-16 US disclosed
WO-2005022257-A2 NOVEL PHOTOSENSITIVE BILAYER COMPOSITION ARCH SPECIALTY CHEMICALS, INC. (US) 2005-03-10 WO disclosed
EP-1509814-A2 ACETAL PROTECTED POLYMERS AND PHOTORESISTS COMPOSITIONS THEREOF Arch Specialty Chemicals, Inc. (US) 2005-03-02 EP disclosed
US-20050042542-A1 Novel photosensitive bilayer composition ARCH SPECIALTY CHEMICALS, INC. 2005-02-24 US disclosed
US-6830870-B2 Mixtures of addition copolymers, acid generators and solvents, used as photosensitive coatings in lithography; relief images ARCH SPECIALITY CHEMICALS, INC. 2004-12-14 US disclosed
US-20040034160-A1 Acetal protected polymers and photoresists compositions thereof ARCH SPECIALITY CHEMICALS, INC. 2004-02-19 US disclosed
WO-2003099782-A2 ACETAL PROTECTED POLYMERS AND PHOTORESISTS COMPOSITIONS THEREOF ARCH SPECIALTY CHEMICALS, INC. (US) 2003-12-04 WO disclosed