SCHEMBL23399954

SCHEMBL23399954

CCCCc1[nH]n(C(C)(C)C)c(=O)c1CC

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.32
▸ TYMP P19971 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
SCHEMBL23400137 0.92 TYMP (0.34) KDM4ETYMP
SCHEMBL23401191 0.90 KDM4E (0.32) KDM4ETYMP
SCHEMBL23398609 0.90 GAA (0.30) —
SCHEMBL23399431 0.87 TYMP (0.33) KDM4ETYMP
SCHEMBL23403204 0.87 TYMP (0.33) KDM4ETYMP
SCHEMBL23403279 0.84 — —
SCHEMBL23401467 0.84 GAA (0.33) KDM4E
SCHEMBL23398654 0.81 GAA (0.33) KDM4ETYMP
SCHEMBL23402696 0.81 KDM4E (0.31) KDM4ETYMP
SCHEMBL23399247 0.80 KDM4E (0.32) KDM4E

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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