SCHEMBL4249027

SCHEMBL4249027

Cc1ccc(C(=O)N(CCCNC(=O)OC(C)(C)C)[C@@H](c2cc3c(Cl)c(C)nn3c(=O)n2Cc2ccccc2)C(C)C)cc1F

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 13/20 0.48
KIF23 Q02241 1/20 0.39
MAP1LC3B Q9GZQ8 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
KCNH2 Q12809 1/20 0.38
PDE6D O43924 3/20 0.38
GNRHR P30968 1/20 0.35
MC4R P32245 1/20 0.35
BRD4 O60885 1/20 0.34

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
SCHEMBL4256007 0.93 KIF11 (0.47) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4252601 0.93 KIF11 (0.47) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4247219 0.92 KIF11 (0.45) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4254486 0.92 KIF11 (0.47) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4246754 0.92 KIF11 (0.47) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4248040 0.91 KIF11 (0.47) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4247903 0.90 KIF11 (0.46) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4246745 0.89 KIF11 (0.42) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4051427 0.89 KIF11 (0.55) KIF11KIF23MAP1LC3BCYP3A4CYP2C19
SCHEMBL4245642 0.88 KIF11 (0.48) KIF11MAP1LC3BCYP3A4CYP2C19KCNH2

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-2035426-A1 PYRAZOLOPYRIMIDONES 4SC AG (DE) 2009-03-18 EP disclosed
WO-2007144384-A1 PYRAZOLOPYRIMIDONES 4SC AG (DE) 2007-12-21 WO disclosed