SCHEMBL4738663

SCHEMBL4738663

O=C=NC1=CCC(=O)C=C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
CYP3A4 P08684 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
SCHEMBL15981012 0.70
SCHEMBL14627773 0.67
SCHEMBL10762001 0.66 CYP1A2 (0.33) CYP3A4
SCHEMBL420160 0.65
SCHEMBL12038664 0.64
SCHEMBL328287 0.63
SCHEMBL7611283 0.62 GSK3A (0.36) GSK3AGSK3B
SCHEMBL2375189 0.61
SCHEMBL8214991 0.60
SCHEMBL998545 0.60

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
WO-2008080223-A1 COMPOSITIONS AND METHODS FOR TREATING HYPERPROLIFERATIVE DISEASE MIGENIX INC. (CA) 2008-07-10 WO disclosed