SCHEMBL29638828

SCHEMBL29638828

CCC1(CC)c2ccccc2-c2ccc(B3OC(C)(C)C(C)(C)O3)cc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 14/20 0.44
LPL P06858 13/20 0.44
PRMT5 O14744 1/20 0.38
WDR77 Q9BQA1 1/20 0.38
ROCK1 Q13464 1/20 0.36
F11 P03951 1/20 0.35
P4HB P07237 1/20 0.34
BACE1 P56817 1/20 0.33

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
SCHEMBL12056854 1.00 LIPG (0.44) LIPGLPLPRMT5WDR77ROCK1
SCHEMBL431831 0.95 LIPG (0.47) LIPGLPLPRMT5WDR77ROCK1
SCHEMBL9901342 0.93 LIPG (0.47) LIPGLPLPRMT5WDR77F11
SCHEMBL431827 0.91 LIPG (0.44) LIPGLPLPRMT5WDR77ROCK1
SCHEMBL20715048 0.89 LIPG (0.43) LIPGLPLPRMT5WDR77ROCK1
SCHEMBL5095856 0.87 LIPG (0.47) LIPGLPLPRMT5WDR77ROCK1
SCHEMBL762282 0.86 LIPG (0.44) LIPGLPLPRMT5WDR77ROCK1
SCHEMBL14066755 0.85 LIPG (0.39) LIPGLPLPRMT5WDR77BACE1
SCHEMBL5095697 0.84 LPL (0.48) LIPGLPLPRMT5WDR77ROCK1
SCHEMBL29950749 0.84 LPL (0.48) LIPGLPLPRMT5WDR77ROCK1

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-4263747-A1 PLASTIC SCINTILLATORS ALLOWING INTRINSIC EMISSION AMPLIFIED BY PURCELL EFFECT Commissariat à l'Energie Atomique et aux Energies Alternatives (FR) 2023-10-25 EP disclosed
WO-2022136145-A1 PLASTIC SCINTILLATORS ALLOWING INTRINSIC EMISSION AMPLIFIED BY PURCELL EFFECT COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2022-06-30 WO disclosed