SCHEMBL23399499

SCHEMBL23399499

CCc1[nH]n(C)c(=O)c1C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ GLA P06280 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ NOX4 Q9NPH5 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.31
▸ HCAR2 Q8TDS4 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
SCHEMBL23399670 0.83 PDE4A (0.32) MEN1KMT2ANOX4ALOX5KDM4E
SCHEMBL23401029 0.79 KDM4E (0.34) ALDH1A1ALOX5KDM4E
SCHEMBL23401585 0.77 MEN1 (0.33) MEN1KMT2AGLAALDH1A1ALOX5
SCHEMBL23403430 0.77 DAO (0.31) NOX4
SCHEMBL23400523 0.77 ALDH1A1 (0.35) ALDH1A1KDM4E
SCHEMBL23403594 0.76 HSD17B10 (0.31) HSD17B10
SCHEMBL23399703 0.72 POLB (0.33) MEN1KMT2AGLANOX4KDM4E
SCHEMBL23401921 0.72 ALDH1A1 (0.30) ALDH1A1
SCHEMBL23401810 0.72 GAA (0.36) MEN1KMT2AALDH1A1
SCHEMBL23398857 0.72 MEN1 (0.31) MEN1KMT2AGLA

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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