SCHEMBL24824904

SCHEMBL24824904

c1ccc(-c2ccc(N(c3ccc(-c4cc5ccccc5c5ccccc45)cc3)c3cccc4c3ccc3c5ccccc5sc43)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.38
CYP11B1 P15538 1/20 0.34
CYP1A1 P04798 1/20 0.34
CYP1B1 Q16678 1/20 0.34
MAPT P10636 2/20 0.33
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
F9 P00740 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
MPI P34949 1/20 0.33
KMT2A Q03164 1/20 0.33
GPR84 Q9NQS5 2/20 0.33
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
PRKDC P78527 1/20 0.31
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL26021480 0.95 ALOX5 (0.39) ALOX5CYP1A1CYP1B1TNKSTNKS2
SCHEMBL24889484 0.93 ALOX5 (0.39) ALOX5CYP11B1CYP1A1CYP1B1MAPT
SCHEMBL23258164 0.93 ALOX5 (0.40) ALOX5CYP11B1CYP1A1CYP1B1MAPT
SCHEMBL23258268 0.93 ALOX5 (0.40) ALOX5CYP11B1CYP1A1CYP1B1MAPT
SCHEMBL23258185 0.93 ALOX5 (0.40) ALOX5CYP11B1CYP1A1CYP1B1MAPT
SCHEMBL26020472 0.93 ALOX5 (0.37) ALOX5CYP11B1CYP1A1CYP1B1TNKS
SCHEMBL26021509 0.92 ALOX5 (0.36) ALOX5CYP1A1CYP1B1TNKSTNKS2
SCHEMBL24825833 0.92 MAPT (0.37) ALOX5CYP11B1MAPTTNKSTNKS2
SCHEMBL26022020 0.91 ALOX5 (0.37) ALOX5CYP11B1CYP1A1CYP1B1TNKS
SCHEMBL23258159 0.91 ALOX5 (0.38) ALOX5CYP11B1MAPTTNKSTNKS2

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-20220416174-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2022-12-29 US disclosed