SCHEMBL23398960

SCHEMBL23398960

CCc1[nH]n(C(C)C)c(=O)c1CC

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 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
SCHEMBL23399367 0.87 — —
SCHEMBL23401759 0.87 KDM4E (0.31) KDM4EALDH1A1HPGD
SCHEMBL23399137 0.87 TYMP (0.30) —
SCHEMBL23398703 0.84 TYMP (0.33) KDM4E
SCHEMBL23402883 0.84 TYMP (0.30) —
SCHEMBL23401921 0.80 ALDH1A1 (0.30) ALDH1A1
SCHEMBL23401480 0.80 ALDH1A1 (0.35) KDM4EALDH1A1HPGD
SCHEMBL23402668 0.78 — —
SCHEMBL23398711 0.76 — —
SCHEMBL23400841 0.76 — —

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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