SCHEMBL8294137

SCHEMBL8294137

CSc1ccc(/C=[N+](\[O-])C(C)(C)C)c(SC)c1

nearest known ligand 0.40

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.33

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
SCHEMBL2800845 1.00 FBP1 (0.33) FBP1
SCHEMBL14390596 0.81 MCL1 (0.30)
SCHEMBL8294647 0.80 LMNA (0.34) FBP1
SCHEMBL5552843 0.80 LMNA (0.34) FBP1
SCHEMBL2798775 0.78 ALOX5 (0.39)
SCHEMBL2799501 0.74 FBP1 (0.49) FBP1
SCHEMBL2800253 0.70 ALDH1A1 (0.48) FBP1
SCHEMBL8293081 0.67 HDAC1 (0.45)
SCHEMBL5552888 0.67 HDAC1 (0.45)
SCHEMBL8292438 0.66 HPGD (0.47)

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-2005016272-A2 ARYL, HETEROAROMATIC AND BICYCLIC ARYL NITRONE COMPOUNDS, PRODRUGS AND PHARMACEUTICAL COMPOSITIONS OF THE SAME TO TREAT HUMAN DISORDERS RENOVIS, INC. (US) 2005-02-24 WO disclosed