SCHEMBL23398396

SCHEMBL23398396

CCn1[nH]c(C)c(C)c1=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ALKBH3 Q96Q83 1/20 0.31
▸ F2 P00734 1/20 0.31
▸ ELANE P08246 1/20 0.31
▸ CTSG P08311 1/20 0.31
▸ CTRC Q99895 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
SCHEMBL23401326 0.82 ALDH1A1 (0.37) —
SCHEMBL23401804 0.79 PDE4A (0.40) —
SCHEMBL23403594 0.77 HSD17B10 (0.31) —
SCHEMBL22292178 0.77 — —
SCHEMBL23399878 0.77 ALDH1A1 (0.36) —
SCHEMBL23401086 0.76 — —
SCHEMBL23399676 0.76 SMN1; SMN2 (0.39) —
SCHEMBL23400317 0.74 — —
SCHEMBL23398894 0.74 — —
SCHEMBL23402619 0.73 NPC1 (0.38) —

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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