SCHEMBL20180339

SCHEMBL20180339

CC1(C)OB(c2cccc(-c3ccc4sccc4c3)c2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.50
LPL P06858 8/20 0.50
DYRK1A Q13627 1/20 0.43
CA2 P00918 8/20 0.41
CA12 O43570 7/20 0.41
SNCA P37840 1/20 0.37
PTGS2 P35354 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
SCHEMBL20984006 0.89 LIPG (0.60) LIPGLPLDYRK1ACA2CA12
SCHEMBL30620315 0.84 LPL (0.47) LIPGLPLDYRK1ACA2CA12
SCHEMBL451893 0.84 LPL (0.47) LIPGLPLDYRK1ACA2CA12
SCHEMBL806784 0.82 LIPG (0.60) LIPGLPLCA2CA12
SCHEMBL31456345 0.80 LIPG (0.58) LIPGLPLCA2CA12
SCHEMBL31456342 0.80 LIPG (0.58) LIPGLPLCA2CA12
SCHEMBL20023287 0.80 LIPG (0.58) LIPGLPLCA2CA12
SCHEMBL24770337 0.80 LIPG (0.72) LIPGLPLSNCA
SCHEMBL22025719 0.80 LIPG (0.77) LIPGLPLSNCA
SCHEMBL24353190 0.80 LIPG (0.77) LIPGLPLSNCA

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
WO-2018093107-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2018-05-24 WO disclosed