SCHEMBL4247219

SCHEMBL4247219

Cc1nn2c(=O)n(Cc3ccccc3)c([C@@H](C(C)C)N(CCCNC(=O)OC(C)(C)C)C(=O)c3ccc(Cl)c(Cl)c3)cc2c1Cl

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 11/20 0.45
PDE6D O43924 3/20 0.38
KIF23 Q02241 1/20 0.38
MAP1LC3B Q9GZQ8 2/20 0.38
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
KCNH2 Q12809 1/20 0.38
MC4R P32245 1/20 0.36
BRD4 O60885 1/20 0.35

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
SCHEMBL4246754 0.93 KIF11 (0.47) KIF11PDE6DKIF23MAP1LC3BCYP3A4
SCHEMBL4254486 0.93 KIF11 (0.47) KIF11PDE6DKIF23MAP1LC3BCYP3A4
SCHEMBL4249027 0.92 KIF11 (0.48) KIF11PDE6DKIF23MAP1LC3BCYP3A4
SCHEMBL4252601 0.92 KIF11 (0.47) KIF11PDE6DKIF23MAP1LC3BCYP3A4
SCHEMBL4256007 0.92 KIF11 (0.47) KIF11PDE6DKIF23MAP1LC3BCYP3A4
SCHEMBL4248040 0.92 KIF11 (0.47) KIF11PDE6DKIF23MAP1LC3BCYP3A4
SCHEMBL4247903 0.91 KIF11 (0.46) KIF11PDE6DKIF23MAP1LC3BSIGMAR1
SCHEMBL4245075 0.89 KIF11 (0.41) KIF11PDE6DKIF23MAP1LC3BTMEM97
SCHEMBL4047520 0.88 KIF11 (0.48) KIF11PDE6DKIF23MAP1LC3BCYP3A4
SCHEMBL4253760 0.87 KIF11 (0.49) KIF11PDE6DMAP1LC3BCYP3A4CYP2C19

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