SCHEMBL29211116

SCHEMBL29211116

CCCC=C(O)C(=O)Oc1ccccc1.CCCCCCC=C(O)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZDHHC2 Q9UIJ5 1/20 0.45
EP300 Q09472 1/20 0.43
FAAH O00519 7/20 0.41
PPARA Q07869 3/20 0.39
SOAT2 O75908 1/20 0.39
SOAT1 P35610 1/20 0.39
PPARG P37231 2/20 0.38
EPHX2 P34913 1/20 0.37
PLA2G4B P0C869 1/20 0.36

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
SCHEMBL29211121 0.93 ZDHHC2 (0.50) ZDHHC2EP300FAAHPPARASOAT2
SCHEMBL29211105 0.93 ZDHHC2 (0.50) ZDHHC2EP300FAAHPPARASOAT2
SCHEMBL29211107 0.92 ZDHHC2 (0.48) ZDHHC2EP300FAAHPPARASOAT2
SCHEMBL29211082 0.87 ZDHHC2 (0.46) ZDHHC2FAAH
SCHEMBL29211078 0.87 ZDHHC2 (0.41) ZDHHC2FAAH
SCHEMBL868457 0.81 ZDHHC2 (0.49) ZDHHC2EP300FAAHPPARASOAT2
SCHEMBL27956126 0.81 ZDHHC2 (0.49) ZDHHC2EP300FAAHPPARASOAT2
SCHEMBL27909024 0.81 ZDHHC2 (0.49) ZDHHC2EP300FAAHPPARASOAT2
SCHEMBL18420300 0.81 ZDHHC2 (0.49) ZDHHC2EP300FAAHPPARASOAT2
SCHEMBL27617091 0.81 ZDHHC2 (0.49) ZDHHC2EP300FAAHPPARASOAT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117529377-A Organic binder, composition for producing inorganic material molded body, green body, degreased body, inorganic material molded body, and method for producing inorganic material molded body 株式会社吴羽 2024-02-06 CN disclosed