SCHEMBL23839674

SCHEMBL23839674

CC1(C)c2cc(B3OC(C)(C)C(C)(C)O3)ccc2-c2ccc(-c3ccc4ccc5cccc6ccc3c4c56)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 10/20 0.46
▸ LPL P06858 9/20 0.46
▸ IRAK4 Q9NWZ3 1/20 0.35
▸ PRMT5 O14744 1/20 0.34
▸ WDR77 Q9BQA1 1/20 0.34
▸ ERBB2 P04626 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ FYN P06241 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ ACHE P22303 1/20 0.33
▸ AHR P35869 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ EGFR P00533 1/20 0.31
▸ SNCA P37840 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
SCHEMBL17268984 0.89 LPL (0.38) LIPGLPLPRMT5WDR77
SCHEMBL14506123 0.88 LIPG (0.57) LIPGLPLIRAK4PRMT5WDR77
SCHEMBL31343000 0.88 LIPG (0.57) LIPGLPLIRAK4PRMT5WDR77
SCHEMBL30009533 0.85 LIPG (0.46) LIPGLPLIRAK4PRMT5WDR77
SCHEMBL12424936 0.85 LIPG (0.46) LIPGLPLIRAK4PRMT5WDR77
SCHEMBL29892494 0.85 LIPG (0.55) LIPGLPLERBB2CYP1A2FYN
SCHEMBL17940716 0.85 LIPG (0.55) LIPGLPLERBB2CYP1A2FYN
SCHEMBL1155615 0.85 ALDH1A1 (0.42) ERBB2CYP1A2FYNMAOAACHE
SCHEMBL17120273 0.83 LIPG (0.64) LIPGLPLIRAK4PRMT5WDR77
SCHEMBL12056858 0.82 LIPG (0.70) LIPGLPLIRAK4SNCADGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3882238-A1 COMPOUND, MATERIAL FOR AN ORGANIC ELECTROLUMINESCENCE DEVICE AND AN ORGANIC ELECTROLUMINESCENCE DEVICE COMPRISING THE COMPOUND Idemitsu Kosan Co.,Ltd. (JP) 2021-09-22 — — EP disclosed
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