SCHEMBL23950561

SCHEMBL23950561

Cn1cc(-c2nc(-c3ccc(Cl)cc3)cc3c(=O)n(C)cnc23)cn1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 3/20 0.43
FGFR3 P22607 1/20 0.42
KDR P35968 1/20 0.42
F2RL3 Q96RI0 1/20 0.42
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
SYK P43405 2/20 0.38
PIM1 P11309 2/20 0.38
FLT3 P36888 1/20 0.37
ACVR1 Q04771 1/20 0.36
KDM5B Q9UGL1 1/20 0.36
MAPK1 P28482 2/20 0.36
KCNH2 Q12809 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PDPK1 O15530 1/20 0.35
MET P08581 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
SCHEMBL23950576 0.86 EPHB4 (0.41) BRD4FGFR3SYKPIM1FLT3
SCHEMBL23390407 0.83 PIM1 (0.42) FGFR3KDRCNR1CNR2PIM1
SCHEMBL23925521 0.83 AHR (0.38) FGFR3KDRCNR1CNR2KDM5B
SCHEMBL23390451 0.83 AHR (0.42) FGFR3KDRCNR1CNR2MAPK1
SCHEMBL23390448 0.83 AHR (0.42) FGFR3KDRCNR1CNR2MAPK1
SCHEMBL23390159 0.83 FGFR3 (0.38) FGFR3KDRCNR1CNR2SYK
SCHEMBL25463600 0.83 PIK3CA (0.41) FGFR3KDRCNR1CNR2PIM1
SCHEMBL23390162 0.83 FGFR3 (0.38) FGFR3KDRCNR1CNR2SYK
SCHEMBL23390288 0.83 FGFR3 (0.38) FGFR3KDRCNR1CNR2SYK
SCHEMBL29738280 0.82 AHR (0.41) FGFR3KDRCNR1CNR2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021210970-A1 PYRIDOPYRIMIDINONE DERIVATIVES AND THEIR USE AS ARYL HYDROCARBON RECEPTOR MODULATORS DONG-A ST CO., LTD. (KR) 2021-10-21 WO disclosed