SCHEMBL30525239

SCHEMBL30525239

O=C1OC(Cc2ccc(F)c(F)c2)c2ccc(Br)cc21

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 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
SCHEMBL29122666 0.89 MAOB (0.37) MAOB
SCHEMBL30525245 0.86 MDM2 (0.44) —
SCHEMBL30525256 0.85 MAOB (0.40) MAOB
SCHEMBL30525241 0.84 ADORA2A (0.36) —
SCHEMBL30525257 0.84 MAOB (0.37) MAOB
SCHEMBL30525231 0.84 MAOB (0.37) MAOB
SCHEMBL30525228 0.81 MAOB (0.37) MAOB
SCHEMBL30525254 0.81 ADORA2A (0.41) MAOB
SCHEMBL18561734 0.77 ALDH1A1 (0.41) —
SCHEMBL29122912 0.73 MAOB (0.41) MAOB

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-116535397-A Isobenzofuran-1 (3H) -one compound, preparation method, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2023-08-04 — — CN disclosed
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