SCHEMBL4036221

SCHEMBL4036221

CCC(c1nc2onc(C)c2c(=O)n1Cc1ccccc1)N(CCCNC(=O)O)C(=O)C(C)C

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 20/20 0.65

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
SCHEMBL4041101 0.91 KIF11 (0.63) KIF11
SCHEMBL4040565 0.91 KIF11 (0.76) KIF11
SCHEMBL4038230 0.90 KIF11 (0.79) KIF11
SCHEMBL4038608 0.88 KIF11 (0.67) KIF11
SCHEMBL4036121 0.88 KIF11 (0.76) KIF11
SCHEMBL5739693 0.88 KIF11 (0.83) KIF11
SCHEMBL4046092 0.88 KIF11 (0.62) KIF11
SCHEMBL4038393 0.88 KIF11 (0.72) KIF11
SCHEMBL4036341 0.88 KIF11 (0.75) KIF11
SCHEMBL4037064 0.88 KIF11 (0.66) KIF11

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1601673-B1 FUSED HETEROCYCLES AND USES THEREOF ASTRAZENECA AB (SE) 2009-06-10 EP claimed
EP-1601673-B1 FUSED HETEROCYCLES AND USES THEREOF ASTRAZENECA AB (SE) 2009-06-10 EP disclosed
EP-1230243-B1 POYCYLOALKYLPURINES AS ADENOSINE RECEPTOR ANTAGONISTS BIOGEN IDEC INC (US) 2009-03-04 EP disclosed