SCHEMBL26046002

SCHEMBL26046002

c1ccc2c(-c3ccc(N(c4ccc5c(c4)oc4ccccc45)c4ccc5ccc6c7ccccc7ccc6c5c4)cc3)cccc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.36
▸ DUSP3 P51452 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ ACMSD Q8TDX5 1/20 0.35
▸ ENPP3 O14638 1/20 0.35
▸ ENPP1 P22413 1/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ CA12 O43570 2/20 0.35
▸ CA1 P00915 2/20 0.35
▸ CA2 P00918 2/20 0.35
▸ CA9 Q16790 2/20 0.35
▸ HPRT1 P00492 1/20 0.34
▸ HDAC8 Q9BY41 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34

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
SCHEMBL25731099 0.99 AHR (0.37) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL25730825 0.99 AHR (0.37) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL25089591 0.96 CA12 (0.38) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL26063576 0.96 AHR (0.39) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL25089400 0.96 AHR (0.39) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL26056535 0.95 CA12 (0.38) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL26057592 0.95 KDM4E (0.37) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL26056449 0.95 KDM4E (0.37) KDM4EALDH1A1MEN1MAPTHPGD
SCHEMBL26056966 0.95 AHR (0.36) AHRDUSP3KDM4EALDH1A1MEN1
SCHEMBL24029600 0.95 AHR (0.38) AHRDUSP3KDM4EALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024014934-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE AND DISPLAY DEVICE 삼성에스디아이 주식회사 2024-01-18 — — WO disclosed
EP-4235829-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-08-30 — — EP disclosed
WO-2023153905-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-08-17 — — WO disclosed
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