SCHEMBL30429995

SCHEMBL30429995

Brc1cccc2c1oc1ccc3ccccc3c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ AHR P35869 3/20 0.41
▸ CYP1A2 P05177 3/20 0.41
▸ ABCG2 Q9UNQ0 2/20 0.41
▸ CYP1A1 P04798 1/20 0.41
▸ FYN P06241 1/20 0.41
▸ MAPK3 P27361 1/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ POLB P06746 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ LOXL2 Q9Y4K0 1/20 0.40
▸ HNF4A P41235 1/20 0.40
▸ KDM4E B2RXH2 2/20 0.39
▸ CDC14B O60729 1/20 0.38
▸ CDC14A Q9UNH5 1/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ HSD17B10 Q99714 2/20 0.38
▸ CYP2A6 P11509 1/20 0.38
▸ TSHR P16473 1/20 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
SCHEMBL17383068 1.00 TDP1 (0.41) TDP1L3MBTL1AHRCYP1A2ABCG2
SCHEMBL13789696 0.83 L3MBTL1 (0.52) TDP1L3MBTL1AHRCYP1A2ABCG2
SCHEMBL442615 0.81 L3MBTL1 (0.50) TDP1L3MBTL1AHRCYP1A2ABCG2
SCHEMBL29612101 0.81 L3MBTL1 (0.50) TDP1L3MBTL1AHRCYP1A2ABCG2
SCHEMBL19784562 0.81 L3MBTL1 (0.44) TDP1L3MBTL1CYP1A2ABCG2CYP1A1
SCHEMBL31588936 0.81 L3MBTL1 (0.44) TDP1L3MBTL1CYP1A2ABCG2CYP1A1
SCHEMBL24048559 0.80 L3MBTL1 (0.41) TDP1L3MBTL1AHRCYP1A2ABCG2
SCHEMBL22688456 0.80 TDP1 (0.46) TDP1L3MBTL1AHRCYP1A2ABCG2
SCHEMBL29349671 0.80 TDP1 (0.46) TDP1L3MBTL1AHRCYP1A2ABCG2
SCHEMBL23406935 0.80 CDC14B (0.46) AHRLOXL2KDM4ECDC14BCDC14A

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
CN-119219584-A Compound and organic light emitting device comprising the same 株式会社LG化学 2024-12-31 — — CN disclosed
CN-116082282-A Luminescent auxiliary material, preparation method thereof and electroluminescent device 奥来德(上海)光电材料科技有限公司 2023-05-09 — — CN disclosed
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