SCHEMBL26600104

SCHEMBL26600104

CC(C)(C)c1ccc(Nc2csc3ccc(C(C)(C)C)cc23)c(-c2ccccc2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ GRIN2C Q14957 1/20 0.36
▸ NPC1 O15118 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CASP3 P42574 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ SENP8 Q96LD8 2/20 0.34
▸ SENP7 Q9BQF6 2/20 0.34
▸ SENP6 Q9GZR1 2/20 0.34
▸ PLA2G1B P04054 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34
▸ RELA Q04206 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ ATG4B Q9Y4P1 1/20 0.34
▸ ABCG2 Q9UNQ0 2/20 0.34
▸ CCR4 P51679 1/20 0.34
▸ KIF11 P52732 2/20 0.33
▸ PKM P14618 1/20 0.31
▸ GLA P06280 1/20 0.31

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
SCHEMBL30363237 1.00 KDM4E (0.40) KDM4EGRIN2CNPC1ALDH1A1CASP3
SCHEMBL26071400 0.92 PKM (0.40) KDM4EGRIN2CNPC1ALDH1A1CASP3
SCHEMBL26599799 0.89 CCR4 (0.37) KDM4EGRIN2CNPC1ALDH1A1CASP3
SCHEMBL30363236 0.89 CCR4 (0.37) KDM4EGRIN2CNPC1ALDH1A1CASP3
SCHEMBL25629508 0.83 NPC1 (0.46) GRIN2CNPC1ALDH1A1CASP3RAB9A
SCHEMBL23442475 0.83 RXRA (0.32) GRIN2C
SCHEMBL30679848 0.80 ABCG2 (0.41) KDM4EABCG2CCR4DHODH
SCHEMBL28703910 0.80 ABCG2 (0.41) KDM4EABCG2CCR4DHODH
SCHEMBL29985567 0.79 NR3C2 (0.40) KDM4ENPC1ALDH1A1RAB9AL3MBTL1
SCHEMBL23118189 0.78 AKR1C3 (0.46) KDM4ENPC1ALDH1A1CASP3RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250268015-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2025-08-21 — — US disclosed
CN-113906580-B Organic light-emitting element 株式会社LG化学 2023-12-08 — — CN disclosed
EP-4265624-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-10-25 — — EP disclosed
WO-2022139513-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-30 — — WO disclosed
CN-113906580-A Organic light emitting element 株式会社LG化学 2022-01-07 — — CN disclosed
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