SCHEMBL21636045

SCHEMBL21636045

CC1(C)OB(c2cc(-c3ccccc3)cc(-c3ccc4c5ccccc5c5ccccc5c4c3)c2)OC1(C)C

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 11/20 0.61
LPL P06858 10/20 0.61
DGAT1 O75907 1/20 0.36
PDGFRB P09619 1/20 0.35
KDR P35968 1/20 0.35
KEAP1 Q14145 1/20 0.35
NFE2L2 Q16236 1/20 0.35
P4HB P07237 1/20 0.35
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
PLA2G2A P14555 1/20 0.32
PLA2G4A P47712 1/20 0.32
ANPEP P15144 1/20 0.32
LAP3 P28838 1/20 0.32
TNKS2 Q9H2K2 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
SCHEMBL19106690 1.00 LIPG (0.61) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL19106683 0.99 LIPG (0.59) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL18419163 0.95 LIPG (0.53) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL17343996 0.91 LIPG (0.75) LIPGLPLDGAT1KEAP1NFE2L2
SCHEMBL25491282 0.90 LIPG (0.68) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL21207973 0.90 LIPG (0.68) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL17343995 0.90 LIPG (0.68) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL5019885 0.90 LIPG (0.54) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL19106585 0.90 LIPG (0.49) LIPGLPLDGAT1PDGFRBKDR
SCHEMBL24767452 0.89 LIPG (0.71) LIPGLPLDGAT1PDGFRBKDR

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-3823958-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2023-08-23 EP disclosed
WO-2020016264-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-01-23 WO disclosed