SCHEMBL4752855

SCHEMBL4752855

Cc1cccc(C2C(C(=O)c3cccc(O)c3)CN(CCCCN(C)C)CC2c2cc[c]cc2O)c1C

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 2/20 0.34
HTR7 P34969 2/20 0.30
BCHE P06276 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
SCHEMBL4752852 1.00 KIF11 (0.34) KIF11HTR7BCHE
SCHEMBL4749253 0.89 KIF11 (0.32) KIF11
SCHEMBL4749257 0.89 KIF11 (0.32) KIF11
SCHEMBL4752779 0.88 KIF11 (0.42) KIF11HTR7BCHE
SCHEMBL4752782 0.88 KIF11 (0.42) KIF11HTR7BCHE
SCHEMBL4751959 0.88 KIF11 (0.33) KIF11HTR7BCHE
SCHEMBL4751647 0.88 KIF11 (0.31) KIF11HTR7BCHE
SCHEMBL4751648 0.88 KIF11 (0.31) KIF11HTR7BCHE
SCHEMBL4751340 0.87 KIF11 (0.31) KIF11
SCHEMBL4751996 0.86 KIF11 (0.31) KIF11HTR7BCHE

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-2008140810-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-11-20 WO claimed