SCHEMBL26599492

SCHEMBL26599492

CC(C)(C)c1ccc(Nc2cc3c(cc2B2OC(C)(C)C(C)(C)O2)C(C)(C)CCC3(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 1/20 0.36
▸ AKR1C3 P42330 2/20 0.34
▸ AKR1C2 P52895 2/20 0.34
▸ CYP26A1 O43174 3/20 0.34
▸ CYP26B1 Q9NR63 2/20 0.34
▸ RXRA P19793 2/20 0.32
▸ RXRB P28702 1/20 0.32
▸ OPRD1 P41143 1/20 0.31
▸ SLC2A1 P11166 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ PGR P06401 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ RARA P10276 1/20 0.31
▸ RARB P10826 1/20 0.31
▸ RARG P13631 1/20 0.31
▸ TBXA2R P21731 1/20 0.31
▸ BLVRB P30043 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ P2RY1 P47900 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
SCHEMBL29141974 0.90 HIF1A (0.33) HIF1AAKR1C3AKR1C2CYP26A1CYP26B1
SCHEMBL30569511 0.90 HIF1A (0.33) HIF1AAKR1C3AKR1C2CYP26A1CYP26B1
SCHEMBL30569509 0.87 HIF1A (0.32) HIF1AAKR1C3AKR1C2CYP26A1CYP26B1
SCHEMBL30569510 0.86 HIF1A (0.32) HIF1A
SCHEMBL30569502 0.85 CYP26A1 (0.36) HIF1ACYP26A1CYP26B1RXRARXRB
SCHEMBL26599255 0.85 CYP26A1 (0.36) HIF1ACYP26A1CYP26B1RXRARXRB
SCHEMBL25396703 0.85 RARB (0.39) CYP26A1CYP26B1RXRARXRBMEN1
SCHEMBL30363271 0.85 RARB (0.39) CYP26A1CYP26B1RXRARXRBMEN1
SCHEMBL26599658 0.83 LIPG (0.44) AKR1C3CYP26A1RXRARXRBMEN1
SCHEMBL30569512 0.82 AKR1C3 (0.39) HIF1AAKR1C3AKR1C2SLC2A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4265624-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME Lg Chem, Ltd. (KR) 2023-10-25 — — EP 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
WO-2022139513-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2022-06-30 — — WO disclosed
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