SCHEMBL24311883

SCHEMBL24311883

c1ccc(-c2cccc(-c3cc(-c4cccc(-c5ccc(-c6ccccc6)cc5-c5ccccc5)c4)nc(-c4cccc(-c5ccccc5)c4)n3)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.51
KMT2A Q03164 5/20 0.51
MAPT P10636 4/20 0.51
ALDH1A1 P00352 3/20 0.51
HPGD P15428 3/20 0.51
LMNA P02545 3/20 0.51
KDM4E B2RXH2 2/20 0.51
GLA P06280 1/20 0.47
NTSR1 P30989 1/20 0.46
KMO O15229 1/20 0.41
GP6 Q9HCN6 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
APAF1 O14727 1/20 0.40
NPC1 O15118 1/20 0.40
THRB P10828 1/20 0.40
XBP1 P17861 1/20 0.40
PTBP1 P26599 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL22309218 0.93 MEN1 (0.55) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19533205 0.92 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL19533200 0.92 MEN1 (0.50) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22309217 0.92 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22309529 0.92 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL29191890 0.92 MEN1 (0.53) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL26592229 0.91 GP6 (0.43) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17887155 0.90 MEN1 (0.53) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17887096 0.90 MEN1 (0.51) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL21481399 0.90 MEN1 (0.44) MEN1KMT2AMAPTALDH1A1HPGD

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