SCHEMBL23402457

SCHEMBL23402457

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

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 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
SCHEMBL23403459 0.89 TYMP (0.34) GRM5
SCHEMBL23401965 0.88 KDM4E (0.33) GRM5
SCHEMBL23402883 0.87 TYMP (0.30) —
SCHEMBL23400643 0.87 TYMP (0.30) —
SCHEMBL23399367 0.83 — —
SCHEMBL23401064 0.83 KDM5A (0.31) —
SCHEMBL23403381 0.83 GRM5 (0.31) GRM5
SCHEMBL23398697 0.81 — —
SCHEMBL23398703 0.81 TYMP (0.33) —
SCHEMBL23401381 0.80 HTT (0.32) GRM5

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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