SCHEMBL4056829

SCHEMBL4056829

CCC(C)(c1nc2c(Cl)c(C)nn2c(=O)n1Cc1ccccc1)N(CCCCN(C)C)C(=O)c1ccc(C)cc1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 19/20 0.39
MAP1LC3B Q9GZQ8 1/20 0.36

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
SCHEMBL4055444 0.98 KIF11 (0.39) KIF11MAP1LC3B
SCHEMBL4047677 0.95 KIF11 (0.39) KIF11MAP1LC3B
SCHEMBL4245624 0.83 KIF11 (0.41) KIF11
SCHEMBL4249153 0.79 KIF11 (0.40) KIF11
SCHEMBL4056823 0.79 KIF11 (0.46) KIF11
SCHEMBL4255912 0.78 KIF11 (0.40) KIF11MAP1LC3B
SCHEMBL4056826 0.78 KIF11 (0.42) KIF11MAP1LC3B
SCHEMBL4252369 0.77 KIF11 (0.37) KIF11
SCHEMBL4245137 0.77 KIF11 (0.45) KIF11
SCHEMBL4055437 0.77 KIF11 (0.46) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2070932-A1 Pyrazolotriazines 4SC AG (DE) 2009-06-17 EP claimed
EP-2070932-A1 Pyrazolotriazines 4SC AG (DE) 2009-06-17 EP disclosed