SCHEMBL25869756

SCHEMBL25869756

c1ccc(-c2cccc(N(c3ccc4ccc5ccccc5c4c3)c3cccc4c3ccc3oc5ccccc5c34)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ CYP1A2 P05177 5/20 0.36
▸ CYP1A1 P04798 4/20 0.36
▸ ABCG2 Q9UNQ0 4/20 0.36
▸ FYN P06241 2/20 0.36
▸ AHR P35869 2/20 0.36
▸ MAPK3 P27361 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ CYP1B1 Q16678 3/20 0.35
▸ KDM4E B2RXH2 4/20 0.34
▸ HPGD P15428 4/20 0.34
▸ MAPT P10636 3/20 0.34
▸ TSHR P16473 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ GLA P06280 2/20 0.34
▸ HTT P42858 1/20 0.34
▸ ALDH1A1 P00352 3/20 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
SCHEMBL25869743 0.94 TDP1 (0.36) TDP1L3MBTL1CYP1A2CYP1A1ABCG2
SCHEMBL26061204 0.92 TDP1 (0.38) TDP1L3MBTL1CYP1A2CYP1A1ABCG2
SCHEMBL24657993 0.91 TDP1 (0.37) TDP1L3MBTL1CYP1A2CYP1A1ABCG2
SCHEMBL25517229 0.91 PLA2G2A (0.38) ABCG2AHRCYP1B1KDM4EHPGD
SCHEMBL25516015 0.90 PLA2G2A (0.39) L3MBTL1ABCG2AHRCYP1B1KDM4E
SCHEMBL25868764 0.90 ABCG2 (0.39) TDP1L3MBTL1CYP1A2CYP1A1ABCG2
SCHEMBL26325037 0.89 TDP1 (0.36) TDP1L3MBTL1CYP1A2CYP1A1ABCG2
SCHEMBL24540108 0.89 ABCG2 (0.33) TDP1L3MBTL1CYP1A2CYP1A1ABCG2
SCHEMBL23512006 0.89 KDM4E (0.33) TDP1L3MBTL1CYP1A2CYP1A1ABCG2
SCHEMBL25869757 0.89 TDP1 (0.36) TDP1L3MBTL1CYP1A2CYP1A1ABCG2

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
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