SCHEMBL6238319

SCHEMBL6238319

NS(=O)(=O)Nc1ccc(-c2ccc(C(F)(F)F)cc2)nc1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 18/20 0.84
CA1 P00915 1/20 0.64
CA2 P00918 1/20 0.64
KDM1A O60341 1/20 0.47
MAOB P27338 1/20 0.47

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
SCHEMBL5531754 0.81 KIF11 (1.00) KIF11CA1CA2
SCHEMBL1645153 0.79 CA1 (1.00) KIF11CA1CA2
SCHEMBL6257183 0.78 KIF11 (0.65) KIF11CA1CA2KDM1AMAOB
SCHEMBL6240077 0.77 KIF11 (0.55) KIF11KDM1AMAOB
SCHEMBL23226495 0.76 KIF11 (0.56) KIF11
SCHEMBL28530523 0.74 KIF11 (0.61) KIF11KDM1AMAOB
SCHEMBL29690424 0.74 KIF11 (0.61) KIF11KDM1AMAOB
SCHEMBL6235808 0.74 KIF11 (0.65) KIF11CA1CA2
SCHEMBL18078706 0.72 KDM1A (0.57) KIF11KDM1AMAOB
SCHEMBL4342508 0.72 KIF11 (0.59) KIF11KDM1AMAOB

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-2005005382-A2 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2005-01-20 WO disclosed