SCHEMBL23402883

SCHEMBL23402883

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

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ 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
SCHEMBL23403459 0.92 TYMP (0.34) TYMP
SCHEMBL23400643 0.90 TYMP (0.30) TYMP
SCHEMBL23402457 0.87 GRM5 (0.31) —
SCHEMBL23398703 0.87 TYMP (0.33) TYMP
SCHEMBL23398960 0.84 KDM4E (0.30) —
SCHEMBL23398584 0.81 KDM4E (0.32) TYMP
SCHEMBL23401965 0.81 KDM4E (0.33) TYMP
SCHEMBL23401759 0.79 KDM4E (0.31) —
SCHEMBL23399171 0.79 NPC1 (0.37) TYMP
SCHEMBL23399137 0.79 TYMP (0.30) TYMP

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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