SCHEMBL24523713

SCHEMBL24523713

N#Cc1ccc2c3cc(-c4cccc5c4c4ccccc4n5-c4ccccc4)cc4c5ccc(C#N)cc5n(c2c1)c34

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TDP2 O95551 4/20 0.35
G6PD P11413 2/20 0.33
ENPP3 O14638 1/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
MAPK1 P28482 1/20 0.31
CYP2C19 P33261 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
PTGDR2 Q9Y5Y4 1/20 0.31
KMT2A Q03164 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
GRM5 P41594 1/20 0.30

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
SCHEMBL24524203 0.89 TDP2 (0.38) KDM4EATML3MBTL1TDP2G6PD
SCHEMBL20251538 0.87 KDM4E (0.41) KDM4EATML3MBTL1TDP2G6PD
SCHEMBL20251523 0.87 KDM4E (0.41) KDM4EATML3MBTL1TDP2G6PD
SCHEMBL24523716 0.85 ENPP3 (0.35) KDM4EENPP3ALDH1A1PTGDR2KMT2A
SCHEMBL24523790 0.84 KDM4E (0.43) KDM4EATML3MBTL1TDP2G6PD
SCHEMBL24524204 0.84 ATM (0.43) KDM4EATML3MBTL1TDP2G6PD
SCHEMBL24523830 0.84 ENPP3 (0.37) G6PDENPP3PTGDR2
SCHEMBL24523778 0.83 KDM4E (0.42) KDM4EATML3MBTL1TDP2G6PD
SCHEMBL24523884 0.83 KDM4E (0.44) KDM4EATML3MBTL1TDP2G6PD
SCHEMBL20251529 0.83 KDM4E (0.41) KDM4EATML3MBTL1TDP2G6PD

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-2022129116-A1 INDOLO[3.2.1-JK]CARBAZOLE-6-CARBONITRILE DERIVATIVES AS BLUE FLUORESCENT EMITTERS FOR USE IN OLEDS MERCK PATENT GMBH (DE) 2022-06-23 WO disclosed