SCHEMBL30009616

SCHEMBL30009616

CC1(C)OB(c2cccc(-c3ccc4c(ccc5ccccc54)c3)c2)OC1(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.61
LPL P06858 8/20 0.61
CYP1A2 P05177 3/20 0.38
ERBB2 P04626 1/20 0.38
FYN P06241 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
AHR P35869 1/20 0.38
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 2/20 0.37
CYP1B1 Q16678 2/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
HIF1A Q16665 1/20 0.37
HPGD P15428 2/20 0.36
HPRT1 P00492 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
CYP1A1 P04798 1/20 0.35
MAPT P10636 1/20 0.35
HSD17B1 P14061 1/20 0.35

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
SCHEMBL19106674 1.00 LIPG (0.61) LIPGLPLCYP1A2ERBB2FYN
SCHEMBL806846 0.99 LIPG (0.59) LIPGLPLCYP1A2ERBB2FYN
SCHEMBL27255082 0.92 LIPG (0.66) LIPGLPLCYP1A2ERBB2FYN
SCHEMBL25818405 0.92 LIPG (0.62) LIPGLPLCYP1A2ALDH1A1HSD17B10
SCHEMBL19106680 0.91 LIPG (0.60) LIPGLPLCYP1A2ERBB2FYN
SCHEMBL18419166 0.90 LIPG (0.62) LIPGLPLCYP1A2ERBB2FYN
SCHEMBL15600476 0.90 LIPG (0.71) LIPGLPLCYP1A2ERBB2FYN
SCHEMBL25681121 0.89 LIPG (0.51) LIPGLPLALDH1A1HSD17B10HPGD
SCHEMBL19106676 0.89 LIPG (0.62) LIPGLPLCYP1A2ERBB2FYN
SCHEMBL15678315 0.89 LIPG (0.69) LIPGLPLCYP1A2ERBB2FYN

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
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