SCHEMBL23399202

SCHEMBL23399202

CCCn1nc(CC(C)C)c(CC)c1O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
GRIA4 P48058 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
SCHEMBL23401903 0.92 KDM4E (0.32) KDM4EUSP2HPGDHSD17B10GRIA4
SCHEMBL23400127 0.90 ESR1 (0.30)
SCHEMBL23402160 0.90 KDM4E (0.31) KDM4EUSP2HPGDHSD17B10GRIA4
SCHEMBL23400501 0.87 FFAR1 (0.36) KDM4EUSP2HPGDHSD17B10
SCHEMBL23400048 0.87 PTGDR2 (0.31) KDM4EUSP2HPGDHSD17B10GRIA4
SCHEMBL23398768 0.86 KDM4E (0.33) KDM4EUSP2HPGDHSD17B10
SCHEMBL23403502 0.85 KDM4E (0.32) KDM4EUSP2HPGDHSD17B10
SCHEMBL23400727 0.84 ADORA2A (0.32) USP2
SCHEMBL23398847 0.81 KDM4E (0.33) KDM4EUSP2HPGDHSD17B10
SCHEMBL23400647 0.81 USP2 (0.40) USP2

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