SCHEMBL24609482

SCHEMBL24609482

c1ccc2c(c1)sc1ccc(-n3c4ccccc4c4ccc(-c5cc(-n6c7ccccc7c7ccccc76)cc(-n6c7ccccc7c7ccccc76)c5)cc43)cc12

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.37
KDM4E B2RXH2 2/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP1A2 P05177 1/20 0.32
HDAC4 P56524 1/20 0.30
PTPN7 P35236 1/20 0.30
DUSP3 P51452 1/20 0.30
PTPN12 Q05209 1/20 0.30
PTPN22 Q9Y2R2 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
SCHEMBL24609483 0.93 ALDH1A1 (0.40) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL17189532 0.92 GPR3 (0.37) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL17109999 0.92 KDM4E (0.40) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL17109985 0.92 KDM4E (0.42) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL2628330 0.92 GPR3 (0.39) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL17562298 0.91 GPR3 (0.38) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL18851258 0.91 KDM4E (0.41) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL17640375 0.91 ATM (0.49) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL16641524 0.91 PIM3 (0.36) GPR3KDM4EATML3MBTL1MAPT
SCHEMBL804866 0.90 GPR3 (0.42) GPR3KDM4EATML3MBTL1MAPT

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
US-20220216427-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2022-07-07 US disclosed