SCHEMBL30009533

SCHEMBL30009533

CC1(C)OB(c2cccc(-c3ccc4ccc5cccc6ccc3c4c56)c2)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 9/20 0.46
▸ LPL P06858 8/20 0.46
▸ ERBB2 P04626 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ FYN P06241 1/20 0.37
▸ MAOA P21397 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ AHR P35869 1/20 0.37
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ PRMT5 O14744 1/20 0.35
▸ WDR77 Q9BQA1 1/20 0.35
▸ CYP1A1 P04798 1/20 0.32
▸ CYP1B1 Q16678 1/20 0.32

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
SCHEMBL12424936 1.00 LIPG (0.46) LIPGLPLERBB2CYP1A2FYN
SCHEMBL27192811 0.92 LIPG (0.46) LIPGLPLERBB2CYP1A2FYN
SCHEMBL17120271 0.91 LIPG (0.44) LIPGLPLERBB2CYP1A2FYN
SCHEMBL28995622 0.91 LIPG (0.42) LIPGLPLERBB2CYP1A2FYN
SCHEMBL31343000 0.90 LIPG (0.57) LIPGLPLERBB2CYP1A2FYN
SCHEMBL14506123 0.90 LIPG (0.57) LIPGLPLERBB2CYP1A2FYN
SCHEMBL30008879 0.88 LIPG (0.43) LIPGLPLERBB2CYP1A2FYN
SCHEMBL25387967 0.87 LIPG (0.48) LIPGLPLERBB2CYP1A2FYN
SCHEMBL17940716 0.86 LIPG (0.55) LIPGLPLERBB2CYP1A2FYN
SCHEMBL29892494 0.86 LIPG (0.55) LIPGLPLERBB2CYP1A2FYN

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-4238953-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE Idemitsu Kosan Co., Ltd (JP) 2023-09-06 — — EP disclosed
CN-115141196-A Light-emitting element and polycyclic compound for light-emitting element 三星显示有限公司 2022-10-04 — — CN disclosed
Send feedback