SCHEMBL24825970

SCHEMBL24825970

c1ccc2c(-c3ccc(N(c4ccc(-c5cc6ccccc6c6ccccc56)cc4)c4cc5c6ccccc6oc5c5ccccc45)cc3)cccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
ALDH1A1 P00352 3/20 0.33
HSD17B10 Q99714 3/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 2/20 0.33
ENPP3 O14638 1/20 0.33
ENPP1 P22413 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
AHR P35869 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CASP1 P29466 1/20 0.32
HIF1A Q16665 1/20 0.32

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
SCHEMBL24825967 0.94 ALOX5 (0.40) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL24826470 0.94 ALOX5 (0.45) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL24826471 0.93 ALOX5 (0.41) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL24825651 0.93 ALOX5 (0.38) ALOX5ALDH1A1HPGDKDM4EMAPT
SCHEMBL24826469 0.92 ALOX5 (0.40) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL24826688 0.92 ALOX5 (0.35) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL24825487 0.92 KDM4E (0.37) ALOX5ALDH1A1HPGDKDM4EMAPT
SCHEMBL23258131 0.92 ALOX5 (0.41) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL25370764 0.92 ALOX5 (0.47) ALOX5ALDH1A1HSD17B10HPGDKDM4E
SCHEMBL22432029 0.91 ALOX5 (0.46) ALOX5ALDH1A1HSD17B10HPGDKDM4E

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