SCHEMBL31363366

SCHEMBL31363366

C#CCNc1ccc(S(C)(=O)=O)c2c1OCC2

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 1/20 0.34
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ MAOA P21397 1/20 0.31
▸ MAOB P27338 1/20 0.31
▸ EED O75530 1/20 0.31
▸ SUZ12 Q15022 1/20 0.31
▸ EZH2 Q15910 1/20 0.31

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
SCHEMBL29212451 0.77 — —
SCHEMBL25030877 0.76 — —
SCHEMBL30184473 0.76 — —
SCHEMBL31304829 0.76 ALDH1A1 (0.35) LRRK2MAOAMAOB
SCHEMBL31304800 0.74 CA12 (0.31) CA12CA1CA2CA9
SCHEMBL31634117 0.72 — —
SCHEMBL31304823 0.71 LMNA (0.38) —
SCHEMBL31304965 0.71 GPR119 (0.32) LRRK2CA12CA1CA2CA9
SCHEMBL31634055 0.70 LRRK2 (0.31) LRRK2
SCHEMBL31634072 0.68 ACHE (0.31) —

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-120192307-A Compounds targeting p53 mutations 上海齐鲁制药研究中心有限公司 2025-06-24 — — CN disclosed
WO-2025059074-A1 BICYCLIC COMPOUNDS FOR RESTORING MUTANT P53 FUNCTION PMV PHARMACEUTICALS, INC. (US) 2025-03-20 — — WO disclosed
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