SCHEMBL24029593

SCHEMBL24029593

c1ccc2c(-c3ccc(N(c4ccc5oc6ccccc6c5c4)c4ccc5c6ccccc6c6ccccc6c5c4)cc3)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.38
▸ MEN1 O00255 3/20 0.38
▸ MAPT P10636 3/20 0.38
▸ HPGD P15428 3/20 0.38
▸ KMT2A Q03164 3/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ RAB9A P51151 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ MCL1 Q07820 1/20 0.36
▸ ACMSD Q8TDX5 1/20 0.36
▸ ENPP3 O14638 1/20 0.36
▸ ENPP1 P22413 1/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ CA12 O43570 2/20 0.36
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35

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
SCHEMBL16883074 0.96 CA12 (0.39) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL17740639 0.96 ALDH1A1 (0.41) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL17737655 0.96 ALDH1A1 (0.41) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL26055982 0.95 KDM4E (0.37) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL26056449 0.95 KDM4E (0.37) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL25089576 0.95 KDM4E (0.37) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL24029600 0.95 AHR (0.38) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL14295604 0.95 CA12 (0.40) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL26046026 0.94 KDM4E (0.36) ALDH1A1MEN1MAPTHPGDKMT2A
SCHEMBL16883078 0.94 CA12 (0.40) ALDH1A1MEN1MAPTHPGDKMT2A

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
WO-2021261907-A1 ORGANIC LIGHT EMITTING DEVICE 주식회사 엘지화학 2021-12-30 — — WO disclosed
WO-2021230715-A1 ORGANIC LIGHT-EMITTING ELEMENT 주식회사 엘지화학 2021-11-18 — — WO disclosed
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