SCHEMBL24293108

SCHEMBL24293108

c1ccc(-c2ccc3c(-c4cccc(-c5ccc6c(c5)-c5ccccc5C65c6ccccc6-n6c7ccccc7c7cccc5c76)c4)cccc3n2)cc1

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ACACA Q13085 2/20 0.32
KDM4E B2RXH2 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
DUSP3 P51452 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
SCHEMBL21867496 0.95 ACACA (0.33) ACACAKDM4EL3MBTL1ALDH1A1MAPT
SCHEMBL24293077 0.89
SCHEMBL21867808 0.89 ACACA (0.35) ACACAKDM4EL3MBTL1ALDH1A1MAPT
SCHEMBL21867797 0.85 NPC1 (0.41) ALDH1A1MAPT
SCHEMBL24647392 0.85 ACACA (0.39) ACACAKDM4EL3MBTL1ALDH1A1MAPT
SCHEMBL21867772 0.85 MEN1 (0.37) KDM4EALDH1A1MAPTHPGDDUSP3
SCHEMBL24293614 0.84 DUSP3 (0.33) DUSP3
SCHEMBL24293639 0.84 DUSP3 (0.33) DUSP3
SCHEMBL24905033 0.84 DUSP3 (0.33) DUSP3
SCHEMBL24293142 0.84 MEN1 (0.33) KDM4EALDH1A1MAPTHPGD

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 US disclosed
US-20220123218-A1 ORGANIC ELECTROLUMINESCENT DEVICE LG CHEM, LTD. (KR) 2022-04-21 US disclosed