SCHEMBL30363236

SCHEMBL30363236

CC(C)(C)c1ccc(Nc2csc3cc4ccccc4cc23)c(-c2ccccc2)c1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CCR4 P51679 2/20 0.37
▸ GRIN2C Q14957 1/20 0.34
▸ ABCG2 Q9UNQ0 2/20 0.33
▸ GPR84 Q9NQS5 1/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ PLA2G1B P04054 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ NFKB2 Q00653 1/20 0.32
▸ RELA Q04206 1/20 0.32
▸ SENP8 Q96LD8 1/20 0.32
▸ SENP7 Q9BQF6 1/20 0.32
▸ SENP6 Q9GZR1 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ATG4B Q9Y4P1 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ CDC25B P30305 1/20 0.30

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
SCHEMBL26599799 1.00 CCR4 (0.37) CCR4GRIN2CABCG2GPR84NPC1
SCHEMBL30363237 0.89 KDM4E (0.40) CCR4GRIN2CABCG2NPC1ALDH1A1
SCHEMBL26600104 0.89 KDM4E (0.40) CCR4GRIN2CABCG2NPC1ALDH1A1
SCHEMBL26071400 0.86 PKM (0.40) CCR4GRIN2CABCG2GPR84NPC1
SCHEMBL23442475 0.82 RXRA (0.32) GRIN2C
SCHEMBL25629508 0.80 NPC1 (0.46) GRIN2CABCG2NPC1ALDH1A1PLA2G1B
SCHEMBL25120147 0.73 ALDH1A1 (0.44) ABCG2NPC1ALDH1A1PLA2G1BNFKB1
SCHEMBL30561839 0.73 ALDH1A1 (0.44) ABCG2NPC1ALDH1A1PLA2G1BNFKB1
SCHEMBL30503054 0.72 AKR1C3 (0.46) ABCG2NPC1ALDH1A1PLA2G1BNFKB1
SCHEMBL23118189 0.72 AKR1C3 (0.46) ABCG2NPC1ALDH1A1PLA2G1BNFKB1

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-113906580-B Organic light-emitting element 株式会社LG化学 2023-12-08 — — CN disclosed
CN-115989725-A Compound and organic light emitting device including the same 株式会社LG化学 2023-04-18 — — CN disclosed
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