SCHEMBL4953302

SCHEMBL4953302

Cc1ccc(Oc2ncccc2C(=O)NC2CCCn3c2nc(-c2ccncn2)cc3=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.53
GAA P10253 1/20 0.42
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GSK3B P49841 1/20 0.37
CYP3A4 P08684 1/20 0.37
UGCG Q16739 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL4393751 0.92 KDM4E (0.46) L3MBTL1GSK3BUGCGKDM4E
SCHEMBL4387186 0.89 L3MBTL1 (0.56) L3MBTL1GAAMEN1KMT2AUGCG
SCHEMBL4378646 0.89 MEN1 (0.46) L3MBTL1MEN1KMT2AGSK3BCYP3A4
SCHEMBL4377879 0.86 MEN1 (0.45) L3MBTL1MEN1KMT2AGSK3BCYP3A4
SCHEMBL4385219 0.84 MEN1 (0.43) L3MBTL1MEN1KMT2AGSK3BCYP3A4
SCHEMBL2065359 0.83 GSK3B (0.46) MEN1KMT2AGSK3B
SCHEMBL4380168 0.83 GSK3B (0.38) GSK3B
SCHEMBL4385660 0.82 RAB9A (0.48) L3MBTL1MEN1KMT2AGSK3BKDM4E
SCHEMBL4388471 0.81 KDM4E (0.47) L3MBTL1GAAUGCGKDM4E
SCHEMBL2066088 0.81 GSK3B (0.40) GSK3BCYP3A4KDM4E

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
US-8198287-B2 Substituted heteroaryl pyridopyrimidone derivatives SANOFI-AVENTIS (FR) 2012-06-12 US claimed
EP-1939187-A1 Substituted heteroaryl pyridopyrimidone derivatives Sanofi-Aventis (FR) 2008-07-02 EP claimed
EP-1939187-A1 Substituted heteroaryl pyridopyrimidone derivatives Sanofi-Aventis (FR) 2008-07-02 EP disclosed