SCHEMBL4377844

SCHEMBL4377844

COc1ncccc1C(=O)NC1CCn2c1nc(-c1ccncc1)cc2=O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.42
GPR6 P46095 5/20 0.39
ACKR3 P25106 1/20 0.39
NTRK1 P04629 1/20 0.38
TYK2 P29597 3/20 0.38
PDE4D Q08499 1/20 0.38
BRD4 O60885 1/20 0.37
BRPF1 P55201 1/20 0.37
KCNH2 Q12809 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
TACR3 P29371 1/20 0.36
CYP2D6 P10635 1/20 0.36
GSK3B P49841 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
DHODH Q02127 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
SCHEMBL4383616 0.95 MEN1 (0.47) MEN1KMT2AL3MBTL1GPR6ACKR3
SCHEMBL4952879 0.94 MEN1 (0.47) MEN1KMT2AL3MBTL1GPR6ACKR3
SCHEMBL4385219 0.90 MEN1 (0.43) MEN1KMT2AL3MBTL1GPR6NTRK1
SCHEMBL4378646 0.85 MEN1 (0.46) MEN1KMT2AL3MBTL1GPR6ACKR3
SCHEMBL4377879 0.84 MEN1 (0.45) MEN1KMT2AL3MBTL1GPR6ACKR3
SCHEMBL2065326 0.83 KMT2A (0.46) MEN1KMT2ABRD4BRPF1MAPT
SCHEMBL4387186 0.82 L3MBTL1 (0.56) MEN1KMT2AL3MBTL1GAA
SCHEMBL4391908 0.82 MEN1 (0.42) MEN1KMT2ACYP2D6GSK3B
SCHEMBL3661764 0.82 GSK3B (0.45) MEN1KMT2ACYP2D6GSK3B
SCHEMBL2064820 0.82 GSK3B (0.48) GPR6CYP2D6GSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2121635-A2 SUBSTITUTED HETEROARYL PYRIDOPYRIMIDONE DERIVATIVES Sanofi-Aventis (FR) 2009-11-25 EP claimed
WO-2008078196-A2 SUBSTITUTED HETEROARYL PYRIDOPYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2008-07-03 WO claimed
EP-1939187-A1 Substituted heteroaryl pyridopyrimidone derivatives Sanofi-Aventis (FR) 2008-07-02 EP claimed
EP-2121635-A2 SUBSTITUTED HETEROARYL PYRIDOPYRIMIDONE DERIVATIVES Sanofi-Aventis (FR) 2009-11-25 EP disclosed
WO-2008078196-A2 SUBSTITUTED HETEROARYL PYRIDOPYRIMIDONE DERIVATIVES SANOFI-AVENTIS (FR) 2008-07-03 WO disclosed
EP-1939187-A1 Substituted heteroaryl pyridopyrimidone derivatives Sanofi-Aventis (FR) 2008-07-02 EP disclosed