SCHEMBL29458387

SCHEMBL29458387

CC1(C)OB(c2cccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccccc4-c4ccccc4)n3)c2)OC1(C)C

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 9/20 0.52
LPL P06858 8/20 0.52
PDGFRB P09619 1/20 0.38
KDR P35968 1/20 0.38
MEN1 O00255 2/20 0.36
ALDH1A1 P00352 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36
GPR55 Q9Y2T6 1/20 0.35
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
DGAT1 O75907 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
P4HB P07237 1/20 0.33
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
HPGD P15428 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
SCHEMBL26185412 1.00 LIPG (0.52) LIPGLPLPDGFRBKDRMEN1
SCHEMBL27237683 0.97 LIPG (0.48) LIPGLPLPDGFRBKDRMEN1
SCHEMBL30866401 0.96 LIPG (0.47) LIPGLPLPDGFRBKDRMEN1
SCHEMBL30866405 0.96 LIPG (0.47) LIPGLPLPDGFRBKDRMEN1
SCHEMBL30866398 0.96 LIPG (0.49) LIPGLPLPDGFRBKDRMEN1
SCHEMBL19293858 0.92 LIPG (0.61) LIPGLPLPDGFRBKDRMEN1
SCHEMBL16210926 0.92 LIPG (0.61) LIPGLPLPDGFRBKDRMEN1
SCHEMBL29519068 0.92 LIPG (0.61) LIPGLPLPDGFRBKDRMEN1
SCHEMBL29458383 0.92 LIPG (0.61) LIPGLPLPDGFRBKDRMEN1
SCHEMBL31685988 0.92 LIPG (0.61) LIPGLPLPDGFRBKDRMEN1

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-2022075219-A1 TRIAZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2022-04-14 WO disclosed