SCHEMBL22135992

SCHEMBL22135992

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cc(-c5ccc6cnc7ccccc7c6c5)cc5c4sc4ccccc45)n3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
GPR3 P46089 1/20 0.38
LIMK1 P53667 2/20 0.37
MAPK10 P53779 1/20 0.37
PIM3 Q86V86 2/20 0.37
TOP2A P11388 1/20 0.35
TNKS O95271 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
ALOX5 P09917 1/20 0.34
PIK3CA P42336 3/20 0.34
PIK3CD O00329 1/20 0.34
PIK3CB P42338 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34
MAPT P10636 2/20 0.34
ATM Q13315 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33

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
SCHEMBL22136048 0.99 KDM4E (0.38) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22136112 0.94 KDM4E (0.38) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22135987 0.93 LIMK1 (0.37) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22136055 0.92 ALOX5 (0.38) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22136040 0.91 KDM4E (0.38) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22135990 0.91 MAPK10 (0.39) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22136322 0.91 LIMK1 (0.35) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22135991 0.90 LIMK1 (0.37) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22136063 0.90 MAPT (0.39) KDM4EGPR3LIMK1MAPK10PIM3
SCHEMBL22135985 0.89 MAPK10 (0.40) KDM4ELIMK1MAPK10PIM3TNKS

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-2020130553-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME 두산솔루스 주식회사 2020-06-25 WO disclosed