Decanoic Acid

Decanoic Acid

SCHEMBL28384641

CCCCCCCCCC(=O)O.C[N+](C)(C)c1ccccc1

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.59
PPARD Q03181 8/20 0.59
PPARA Q07869 8/20 0.59
GPR84 Q9NQS5 7/20 0.59
HDAC11 Q96DB2 5/20 0.59
TSHR P16473 5/20 0.59
ALDH1A1 P00352 5/20 0.59
PTPN1 P18031 3/20 0.59
TDP1 Q9NUW8 3/20 0.59
FABP4 P15090 3/20 0.59
TLR2 O60603 2/20 0.59
KMT2A Q03164 2/20 0.59
ALOX15 P16050 2/20 0.59
HSD17B10 Q99714 2/20 0.59
FFAR1 O14842 2/20 0.59
FFAR4 Q5NUL3 2/20 0.59
FABP3 P05413 2/20 0.59
SLC22A6 Q4U2R8 1/20 0.59
SLC22A8 Q8TCC7 1/20 0.59
MEN1 O00255 1/20 0.59

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
Myristic Acid SCHEMBL28387565 1.00 PPARG (0.59) PPARGPPARDPPARAGPR84HDAC11
Decanoic Acid SCHEMBL29612108 0.87 FABP3 (0.53) PPARGFABP3
Dodecane SCHEMBL27520039 0.85 APOBEC3A (0.64) ALDH1A1KMT2AMEN1ESR1LMNA
Stearic Acid SCHEMBL28275279 0.84 GPR84 (0.65) PPARGPPARDPPARAGPR84HDAC11
Dodecanoate SCHEMBL28215095 0.83 GPR84 (0.85) PPARGPPARDPPARAGPR84HDAC11
Dodecanoate SCHEMBL5146634 0.82 GPR84 (0.68) PPARGPPARDPPARAGPR84HDAC11
Palmitic Acid SCHEMBL29634079 0.82 GPR84 (0.68) PPARGPPARDPPARAGPR84HDAC11
Stearic Acid SCHEMBL16632630 0.82 GPR84 (0.68) PPARGPPARDPPARAGPR84HDAC11
Behenic Acid SCHEMBL8855897 0.82 GPR84 (0.68) PPARGPPARDPPARAGPR84HDAC11
Stearic Acid SCHEMBL29634243 0.82 GPR84 (0.68) PPARGPPARDPPARAGPR84HDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110922566-B Polyisocyanate composition, method for producing same, coating composition, and coating film 旭化成株式会社 2021-11-19 CN disclosed
CN-110922566-A Polyisocyanate composition, method for producing same, coating composition, and coating film 旭化成株式会社 2020-03-27 CN disclosed