Dodecanoate

Dodecanoate

SCHEMBL29786754

CCCCCCCCCCCC(=O)[O-].CCCCCCCCCCCC(=O)[O-].CCCCC[Sn+2]CCCCC

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 7/20 0.60
CA1 P00915 1/20 0.58
CES2 O00748 4/20 0.54
CES1 P23141 4/20 0.54
NFKB1 P19838 1/20 0.48
GPR84 Q9NQS5 1/20 0.47

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
Dodecanoate SCHEMBL4449154 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Dodecanoate SCHEMBL31452874 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Octanoic Acid SCHEMBL18420918 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Hexanoate SCHEMBL6440248 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Octanoic Acid SCHEMBL916529 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Adipic Acid SCHEMBL6685723 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL8399877 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Adipic Acid SCHEMBL8369794 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Stearic Acid SCHEMBL4454259 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1
Dodecanoate SCHEMBL29714861 1.00 FABP3 (0.60) FABP3CA1CES2CES1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118440662-A Adhesive composition, adhesive, preparation method of adhesive and photovoltaic module 天合光能股份有限公司 2024-08-06 CN claimed
CN-118440662-A Adhesive composition, adhesive, preparation method of adhesive and photovoltaic module 天合光能股份有限公司 2024-08-06 CN disclosed
CN-114763463-A Special floor glue for SPC (super solvent modified) board and preparation method thereof 安徽斯迈特新材料股份有限公司 2022-07-19 CN disclosed