SCHEMBL23692495

SCHEMBL23692495

Bc1cccc2c1oc1ccc3ccccc3c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 3/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ ABCG2 Q9UNQ0 3/20 0.41
▸ AHR P35869 3/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ PAX8 Q06710 2/20 0.41
▸ CYP1A1 P04798 1/20 0.41
▸ FYN P06241 1/20 0.41
▸ MAPK3 P27361 1/20 0.41
▸ HNF4A P41235 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ HPGD P15428 2/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ CYP3A4 P08684 2/20 0.38
▸ MAPT P10636 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ NPC1 O15118 2/20 0.38

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
SCHEMBL13789696 0.83 L3MBTL1 (0.52) TDP1L3MBTL1ABCG2AHRCYP1A2
SCHEMBL10109865 0.82 ALDH1A1 (0.50) TDP1L3MBTL1ABCG2AHRCYP1A2
SCHEMBL24034416 0.81 L3MBTL1 (0.45) TDP1L3MBTL1ABCG2AHRCYP1A2
SCHEMBL25497927 0.81 TNF (0.36) TDP1CYP1A2CYP1A1HSD17B10HPGD
SCHEMBL442615 0.81 L3MBTL1 (0.50) TDP1L3MBTL1ABCG2AHRCYP1A2
SCHEMBL29612101 0.81 L3MBTL1 (0.50) TDP1L3MBTL1ABCG2AHRCYP1A2
SCHEMBL24662731 0.81 L3MBTL1 (0.44) TDP1L3MBTL1ABCG2CYP1A2PAX8
SCHEMBL24662752 0.80 MAOA (0.41) AHRALDH1A1HSD17B10HPGDMEN1
SCHEMBL16548075 0.80 TDP1 (0.46) TDP1L3MBTL1ABCG2AHRCYP1A2
SCHEMBL22315503 0.79 AHR (0.40) TDP1L3MBTL1ABCG2AHRCYP1A2

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
WO-2022169218-A1 METHOD FOR PREPARATION OF DEUTERATED ANTHRACENE COMPOUND, REACTION COMPOSITION, DEUTERATED ANTHRACENE COMPOUND, AND COMPOSITION 주식회사 엘지화학 2022-08-11 — — WO disclosed
WO-2021150094-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-07-29 — — WO disclosed
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