SCHEMBL23401586

SCHEMBL23401586

CC(C)Cc1nn(C)c(O)c1C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PDE2A O00408 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
SCHEMBL23400040 0.82 KDM4E (0.33) KDM4EUSP2HPGDHSD17B10
SCHEMBL23400802 0.81 KDM4E (0.32) KDM4EUSP2HPGDHSD17B10
SCHEMBL23399183 0.80
SCHEMBL23403544 0.79 KDM4E (0.39) KDM4EUSP2HPGDHSD17B10PDE2A
SCHEMBL23400485 0.79 GAA (0.37)
SCHEMBL23400908 0.79 KDM4E (0.31) KDM4EUSP2HPGDHSD17B10
SCHEMBL23398835 0.79 KDM4E (0.31) KDM4EUSP2HPGDHSD17B10
SCHEMBL23399477 0.76 LMNA (0.37)
SCHEMBL23400967 0.76 KDM4E (0.35) KDM4EUSP2HPGDHSD17B10PDE2A
SCHEMBL23402099 0.75 KDM4E (0.33) KDM4EUSP2HPGDHSD17B10PDE2A

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