SCHEMBL26585366

SCHEMBL26585366

c1ccc(-c2cccc3cccc(-c4ccccc4N(c4cccc(-c5cccc6oc7ccccc7c56)c4)c4ccc5c(c4)oc4ccccc45)c23)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HCRTR1 O43613 1/20 0.31
▸ DUSP3 P51452 1/20 0.31
▸ MAOB P27338 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ TP53 P04637 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CASP7 P55210 1/20 0.30
▸ HIF1A Q16665 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL26588749 0.95 MCL1 (0.33) AHRALOX5ALDH1A1KDM4EHPGD
SCHEMBL26585362 0.95 AHR (0.33) AHRALOX5ALDH1A1KDM4EHPGD
SCHEMBL26569739 0.95 AHR (0.34) AHRALOX5ALDH1A1KDM4EHPGD
SCHEMBL26585365 0.95 AHR (0.34) AHRALOX5ALDH1A1KDM4EHPGD
SCHEMBL26584407 0.94 HCRTR1 (0.36) AHRALOX5ALDH1A1KDM4EHPGD
SCHEMBL26585374 0.94 HCRTR1 (0.38) AHRALOX5ALDH1A1KDM4EHPGD
SCHEMBL26584663 0.94 ALOX5 (0.33) ALOX5ALDH1A1KDM4EHPGDMEN1
SCHEMBL26588788 0.93 CYP1A1 (0.32) AHRALOX5ALDH1A1KDM4EHPGD
SCHEMBL26585408 0.93 ALOX5 (0.41) AHRALOX5MEN1MAPTKMT2A
SCHEMBL26588794 0.92 AHR (0.35) AHRALOX5ALDH1A1KDM4EHPGD

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
WO-2023182323-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-09-28 — — WO disclosed
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