Dodecanoate

Dodecanoate

SCHEMBL9840415

CCCCCCCCCCCC(=O)O.[SnH2].c1ccc(-c2ccccc2)cc1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.65
PPARG P37231 7/20 0.65
PPARD Q03181 7/20 0.65
PPARA Q07869 7/20 0.65
HDAC11 Q96DB2 5/20 0.65
TSHR P16473 4/20 0.65
PTPN1 P18031 3/20 0.65
ALDH1A1 P00352 2/20 0.65
TLR2 O60603 2/20 0.65
TDP1 Q9NUW8 2/20 0.65
FABP4 P15090 2/20 0.65
KMT2A Q03164 2/20 0.65
SLC22A6 Q4U2R8 1/20 0.65
SLC22A8 Q8TCC7 1/20 0.65
MEN1 O00255 1/20 0.65
ESR1 P03372 1/20 0.65
ALOX15 P16050 1/20 0.65
PDE4A P27815 1/20 0.65
PDE3A Q14432 1/20 0.65
HSD17B10 Q99714 1/20 0.65

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
Biphenyl SCHEMBL5420709 1.00 GPR84 (0.65) GPR84PPARGPPARDPPARAHDAC11
Dodecanoate SCHEMBL5146634 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL29634079 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Palmitic Acid SCHEMBL8855969 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL29634243 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL8855788 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Biphenyl SCHEMBL28521917 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Myristic Acid SCHEMBL29634265 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Behenic Acid SCHEMBL8855897 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11
Decanoic Acid SCHEMBL5147676 0.98 GPR84 (0.68) GPR84PPARGPPARDPPARAHDAC11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5017636-A Also containing polyisoprene, natural rubber, butadiene-styrene copolymer, wear and heat resistance, resilience JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1991-05-21 US claimed
US-11939466-B2 Thermoplastic polyester resin composition and molded article TORAY INDUSTRIES, INC. (JP) 2024-03-26 US disclosed
EP-3854849-B1 THERMOPLASTIC POLYESTER RESIN COMPOSITION AND MOLDED ARTICLE TORAY INDUSTRIES (JP) 2023-09-06 EP disclosed
US-20210332231-A1 THERMOPLASTIC POLYESTER RESIN COMPOSITION AND MOLDED ARTICLE TORAY INDUSTRIES, INC. (JP) 2021-10-28 US disclosed
EP-3854849-A1 THERMOPLASTIC POLYESTER RESIN COMPOSITION AND MOLDED ARTICLE Toray Industries, Inc. (JP) 2021-07-28 EP disclosed
US-5017636-A Also containing polyisoprene, natural rubber, butadiene-styrene copolymer, wear and heat resistance, resilience JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1991-05-21 US disclosed