SCHEMBL20828561

SCHEMBL20828561

c1ccc(-c2ccc(N(c3ccc(-c4c(-c5ccc6oc7ccccc7c6c5-c5ccccc5)ccc5oc6ccccc6c45)cc3)c3ccc4c(c3)oc3ccccc34)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
THRB P10828 1/20 0.40
RECQL P46063 1/20 0.40
BLM P54132 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
AHR P35869 2/20 0.37
MAPT P10636 4/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
PLA2G2A P14555 3/20 0.36
PLA2G4A P47712 3/20 0.36
MMP12 P39900 1/20 0.34
MMP13 P45452 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
WEE1 P30291 1/20 0.34
CDC25A P30304 2/20 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
SCHEMBL20828565 1.00 MEN1 (0.40) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828559 0.94 MEN1 (0.38) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828703 0.92 CA1 (0.38) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828720 0.92 CA1 (0.38) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828771 0.92 CA1 (0.38) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828636 0.92 CA1 (0.38) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828640 0.92 CA1 (0.38) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828762 0.91 CA1 (0.37) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828587 0.91 CA1 (0.37) MEN1KMT2ATHRBRECQLBLM
SCHEMBL20828585 0.91 CA1 (0.37) MEN1KMT2ATHRBRECQLBLM

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-2019054599-A1 ORGANIC LIGHT EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME (주)피엔에이치테크 2019-03-21 WO disclosed