SCHEMBL26599337

SCHEMBL26599337

CC1(C)CCC(C)(C)c2cc(Nc3c(B4OC(C)(C)C(C)(C)O4)ccc4c3oc3ccccc34)ccc21

nearest known ligand 0.31

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.31
▸ KMT2A Q03164 4/20 0.31
▸ PGR P06401 2/20 0.31
▸ CYP26A1 O43174 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
▸ CYP2C19 P33261 1/20 0.30
▸ KDM4E B2RXH2 2/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ MAPT P10636 2/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TSHR P16473 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
SCHEMBL24562685 0.82 MEN1 (0.33) MEN1KMT2APGRCYP26A1CYP3A4
SCHEMBL26599787 0.81 LPL (0.42) MEN1KMT2APGRCYP2C19KDM4E
SCHEMBL29640010 0.81 LPL (0.42) MEN1KMT2APGRCYP2C19KDM4E
SCHEMBL26599474 0.81 MEN1 (0.35) MEN1KMT2APGRCYP26A1CYP3A4
SCHEMBL22934102 0.77 ALDH1A1 (0.38) MEN1KMT2APGRCYP26A1CYP3A4
SCHEMBL30388350 0.77 KMT2A (0.45) MEN1KMT2APGRCYP26A1CYP3A4
SCHEMBL23421632 0.77 KMT2A (0.45) MEN1KMT2APGRCYP26A1CYP3A4
SCHEMBL26599391 0.75 ALDH1A1 (0.33) MEN1KMT2APGRCYP26A1CYP3A4
SCHEMBL23421685 0.74 MEN1 (0.40) MEN1KMT2APGRCYP26A1CYP3A4
SCHEMBL25791449 0.73 RARB (0.41) RARARARBRARG

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
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
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