SCHEMBL23399512

SCHEMBL23399512

Cc1c(CC(C)C)nn(CC(C)C)c1O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
USP2 O75604 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.33
APAF1 O14727 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
SCHEMBL23401907 0.85 KDM4E (0.37) KDM4EUSP2HPGDHSD17B10
SCHEMBL23400549 0.85 GAA (0.35) KDM4EUSP2HPGDHSD17B10SMN1; SMN2
SCHEMBL23399150 0.82 KDM4E (0.35) KDM4EUSP2HPGDHSD17B10
SCHEMBL23398493 0.82 HTR2A (0.32) SMN1; SMN2
SCHEMBL23400120 0.81 KDM4E (0.33) KDM4EUSP2HPGDHSD17B10SMN1; SMN2
SCHEMBL23400408 0.80 KDM4E (0.33) KDM4EUSP2HPGDHSD17B10
SCHEMBL23399677 0.80 FFAR1 (0.33) SMN1; SMN2
SCHEMBL23401625 0.80 KDM4E (0.33) KDM4EUSP2HPGDHSD17B10
SCHEMBL23398825 0.79 APAF1 (0.44) SMN1; SMN2APAF1
SCHEMBL23400364 0.77 KDM4E (0.39) KDM4EUSP2HPGDHSD17B10

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