SCHEMBL26040219

SCHEMBL26040219

c1ccc(-c2ccccc2N(c2ccc(-c3cccc4ccccc34)cc2)c2cccc3c(-c4ccc5ccc6oc7ccccc7c6c5c4)cccc23)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 3/20 0.34
▸ CYP1A1 P04798 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ FYN P06241 1/20 0.34
▸ MAPK3 P27361 1/20 0.34
▸ AHR P35869 1/20 0.34
▸ PAX8 Q06710 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ ACMSD Q8TDX5 1/20 0.34
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ PLA2G2A P14555 2/20 0.33
▸ PLA2G4A P47712 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33

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
SCHEMBL26039595 0.98 ABCG2 (0.33) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL27297077 0.95 CA12 (0.36) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25868667 0.93 CA12 (0.39) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25869554 0.92 TDP1 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL27297358 0.92 PLA2G2A (0.37) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26039671 0.92 TDP1 (0.32) ABCG2CYP1A2AHRPAX8MCL1
SCHEMBL25868661 0.91 ABCG2 (0.36) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26055425 0.91 MCL1 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26040330 0.91 MCL1 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL24964376 0.90 MCL1 (0.37) MCL1ACMSDCA12CA1CA2

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
EP-4243102-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-09-13 — — EP disclosed
EP-4235830-A1 ORGANIC LIGHT-EMITTING DEVICE Lg Chem, Ltd. (KR) 2023-08-30 — — EP disclosed
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