SCHEMBL19003945

SCHEMBL19003945

CC1(C)OB(c2cccc(-c3cccc(-c4cccc(-c5ccc6c(c5)c5ccccc5c5nccnc65)c4)c3)c2)OC1(C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.44
LPL P06858 8/20 0.44
DGAT1 O75907 1/20 0.34
EGFR P00533 1/20 0.34
PDGFRB P09619 1/20 0.33
KDR P35968 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.32

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
SCHEMBL19003972 1.00 LIPG (0.44) LIPGLPLDGAT1EGFRPDGFRB
SCHEMBL19003896 0.99 LIPG (0.46) LIPGLPLDGAT1EGFRPDGFRB
SCHEMBL5019885 0.90 LIPG (0.54) LIPGLPLDGAT1EGFRPDGFRB
SCHEMBL30009275 0.88 LIPG (0.56) LIPGLPLDGAT1EGFRPDGFRB
SCHEMBL31576191 0.88 LIPG (0.56) LIPGLPLDGAT1EGFRPDGFRB
SCHEMBL1295207 0.88 LIPG (0.56) LIPGLPLDGAT1EGFRPDGFRB
SCHEMBL17782981 0.86 LIPG (0.40) LIPGLPLDGAT1EGFRPDGFRB
SCHEMBL19651115 0.86 LPL (0.45) LIPGLPLDGAT1EGFRPRMT5
SCHEMBL19003692 0.85 LIPG (0.36) LIPGLPLPDGFRBKDRPRMT5
SCHEMBL19003955 0.84 LIPG (0.48) LIPGLPLDGAT1EGFRPDGFRB

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-2017104946-A1 ORGANIC COMPOUND, COMPOSITION, ORGANIC OPTOELECTRONIC ELEMENT, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2017-06-22 WO disclosed