SCHEMBL21944334

SCHEMBL21944334

CCCCCCCCCCCCCCCCCCCCCCC1(C)c2cc(B3OC(C)(C)C(C)(C)O3)ccc2-c2ccc(B3OC(C)(C)C(C)(C)O3)cc21

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 14/20 0.54
LPL P06858 13/20 0.54
F11 P03951 1/20 0.34
ESR2 Q92731 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
CA12 O43570 1/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
HIF1A Q16665 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
SCHEMBL20180874 1.00 LIPG (0.54) LIPGLPLF11ESR2CA1
SCHEMBL15219034 1.00 LIPG (0.54) LIPGLPLF11ESR2CA1
SCHEMBL20233449 0.94 LPL (0.48) LIPGLPLF11PRMT5WDR77
SCHEMBL13429530 0.93 LPL (0.47) LIPGLPLF11
SCHEMBL20233453 0.93 LIPG (0.50) LIPGLPLF11ESR2CA1
SCHEMBL2956994 0.89 LIPG (0.54) LIPGLPLF11ESR2CA1
SCHEMBL14840000 0.89 LIPG (0.54) LIPGLPLF11ESR2CA1
SCHEMBL1681942 0.89 LIPG (0.54) LIPGLPLF11ESR2CA1
SCHEMBL370287 0.89 LIPG (0.54) LIPGLPLF11ESR2CA1
SCHEMBL32661735 0.89 LIPG (0.54) LIPGLPLF11ESR2CA1

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-2702084-B1 MATERIALS FOR OPTOELECTRONIC DEVICES BOE TECHNOLOGY GROUP CO LTD (CN) 2020-04-29 EP disclosed