SCHEMBL28927366

SCHEMBL28927366

COc1ccc2c(c1)CC(=Cc1ccc(Br)cc1)C2=O

nearest known ligand 0.76

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.76
MAOA P21397 4/20 0.73
CYP19A1 P11511 2/20 0.72
ACHE P22303 4/20 0.65
BCHE P06276 1/20 0.64
CES2 O00748 2/20 0.63
MIF P14174 4/20 0.60
CYP26A1 O43174 1/20 0.60
HRH3 Q9Y5N1 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
SCHEMBL30413593 1.00 MAOB (0.76) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL28927416 0.92 MAOB (0.84) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL30413650 0.92 MAOB (0.84) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL6990912 0.92 MAOB (0.84) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL28927347 0.88 MAOB (0.78) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL30412163 0.88 MAOB (0.78) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL28927385 0.86 MAOB (0.76) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL5581835 0.86 MAOB (0.76) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL30412903 0.86 MAOB (0.76) MAOBMAOACYP19A1ACHEBCHE
SCHEMBL5581839 0.86 MAOB (0.76) MAOBMAOACYP19A1ACHEBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115417871-B Double spiro pyrrolospirone oxindole compound, synthesis method and antifungal activity thereof 成都理工大学 2023-06-02 CN claimed
CN-115417871-A Double-spiro pyrrole spiro oxindole compound and synthesis method and antifungal activity thereof 成都理工大学 2022-12-02 CN claimed
CN-115417871-B Double spiro pyrrolospirone oxindole compound, synthesis method and antifungal activity thereof 成都理工大学 2023-06-02 CN disclosed
CN-115417871-A Double-spiro pyrrole spiro oxindole compound and synthesis method and antifungal activity thereof 成都理工大学 2022-12-02 CN disclosed