SCHEMBL25506752

SCHEMBL25506752

N=C(/N=C(\N)c1cccc2oc3ccccc3c12)c1ccc(-c2ccc3c(ccc4oc5ccccc5c43)c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 1/20 0.37
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 4/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
GLA P06280 2/20 0.34
CHEK2 O96017 1/20 0.33
ABCG2 Q9UNQ0 3/20 0.32
PDPK1 O15530 1/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 1/20 0.32
PAX8 Q06710 1/20 0.32
PLAU P00749 1/20 0.32
CASP3 P42574 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
HCRTR1 O43613 1/20 0.31
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL25506602 0.92 HTR2B (0.36) HTR2BALDH1A1MAPTMEN1KMT2A
SCHEMBL24657333 0.92 HTR2B (0.35) HTR2BALDH1A1MAPTMEN1KMT2A
SCHEMBL24656629 0.88 ERBB2 (0.35) HTR2BALDH1A1MAPTMEN1KMT2A
SCHEMBL25008980 0.87 WDR5 (0.40) HTR2BALDH1A1GLAHPGDKLKB1
SCHEMBL25654493 0.86 PRSS1 (0.38) HTR2BCHEK2PLAUKLKB1TTR
SCHEMBL23822492 0.84 PLAU (0.38) HTR2BALDH1A1MAPTMEN1KMT2A
SCHEMBL24655499 0.84 PRSS1 (0.40) HTR2BALDH1A1MAPTGLAPLAU
SCHEMBL24658270 0.83 HCRTR1 (0.36) HTR2BALDH1A1MAPTMEN1KMT2A
SCHEMBL24655489 0.82 PLAU (0.36) HTR2BALDH1A1MAPTNPC1RAB9A
SCHEMBL25506496 0.82 HTR2B (0.36) HTR2BALDH1A1MAPTMEN1KMT2A

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-2023096318-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2023-06-01 WO disclosed