SCHEMBL23403430

SCHEMBL23403430

Cc1c(CC(C)C)[nH]n(C)c1=O

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ DAO P14920 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HPD P32754 1/20 0.30
▸ NOX4 Q9NPH5 1/20 0.30

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
SCHEMBL23398530 0.80 KDM5A (0.31) DAOTSHR
SCHEMBL23400276 0.78 — —
SCHEMBL23401409 0.78 HTT (0.35) DAO
SCHEMBL23399300 0.77 — —
SCHEMBL23400088 0.77 SMN1; SMN2 (0.36) TSHR
SCHEMBL23403351 0.77 KDM4E (0.32) —
SCHEMBL23399499 0.77 MEN1 (0.33) NOX4
SCHEMBL23401783 0.76 PDE2A (0.30) —
SCHEMBL23400038 0.76 GAA (0.33) DAO
SCHEMBL23399670 0.73 PDE4A (0.32) HPDNOX4

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
EP-3828159-A1 STORAGE AND TRANSPORT STABILIZERS FOR POLYMERIZABLE COMPOUNDS BASF SE (DE) 2021-06-02 — — EP disclosed
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