SCHEMBL27286752

SCHEMBL27286752

c1ccc(-c2c(-c3c4ccccc4c(-c4cccc5c4oc4ccc6ccccc6c45)c4ccccc34)oc3c2ccc2c4ccccc4oc23)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.38
▸ ABCG2 Q9UNQ0 5/20 0.37
▸ ADORA2A P29274 1/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ FYN P06241 1/20 0.36
▸ MAPK3 P27361 1/20 0.36
▸ AHR P35869 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ ABCC1 P33527 1/20 0.35
▸ ALDH1A1 P00352 4/20 0.34
▸ MAPT P10636 4/20 0.34
▸ HPGD P15428 4/20 0.34
▸ HSD17B10 Q99714 4/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ TSHR P16473 2/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ CASP1 P29466 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
SCHEMBL27287148 0.92 TDP1 (0.38) ALOX5ABCG2ADORA2ATDP1L3MBTL1
SCHEMBL17943882 0.84 ABCG2 (0.44) ABCG2TDP1L3MBTL1CYP1A1CYP1A2
SCHEMBL27288237 0.83 PRKDC (0.33) ALOX5ABCG2CYP1A1CYP1A2FYN
SCHEMBL27288588 0.83 ABCG2 (0.33) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL22218969 0.83 ABCG2 (0.43) ABCG2TDP1L3MBTL1CYP1A1CYP1A2
SCHEMBL27287155 0.82 ABCG2 (0.36) ALOX5ABCG2ADORA2ATDP1CYP1A1
SCHEMBL17931907 0.82 ABCG2 (0.43) ALOX5ABCG2TDP1L3MBTL1CYP1A1
SCHEMBL25800330 0.82 ALOX5 (0.47) ALOX5ABCG2ADORA2AALDH1A1MAPT
SCHEMBL27287487 0.81 ALOX5 (0.35) ALOX5ABCG2TDP1L3MBTL1CYP1A1
SCHEMBL24662766 0.81 ALOX5 (0.46) ALOX5ADORA2AL3MBTL1CYP1A1CYP1A2

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-2024010167-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-01-11 — — WO disclosed
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