SCHEMBL23398530

SCHEMBL23398530

CC(C)Cc1[nH]n(C)c(=O)c1CC(C)C

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM5A P29375 1/20 0.31
▸ DAO P14920 1/20 0.31
▸ TSHR P16473 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
SCHEMBL23403351 0.89 KDM4E (0.32) —
SCHEMBL23403052 0.89 KDM5A (0.30) KDM5A
SCHEMBL23402796 0.85 HTT (0.32) —
SCHEMBL23402934 0.85 HTT (0.32) —
SCHEMBL23403381 0.83 GRM5 (0.31) —
SCHEMBL23401812 0.83 KDM4E (0.33) —
SCHEMBL23403430 0.80 DAO (0.31) DAOTSHR
SCHEMBL23403038 0.80 HPD (0.35) KDM5ADAOTSHR
SCHEMBL23401064 0.78 KDM5A (0.31) KDM5A
SCHEMBL23403134 0.78 KDM5A (0.31) KDM5ADAO

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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