SCHEMBL22989094

SCHEMBL22989094

c1ccc(-c2cc3ccccc3nc2-c2ccc3ccc(-n4c5ccc6cccc7sc8cccc9ccc4c(c98)c5c67)cc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.38
PSMB5 P28074 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
PDE10A Q9Y233 4/20 0.32
MAPK9 P45984 1/20 0.31
MAPK10 P53779 1/20 0.31
CSNK1D P48730 3/20 0.30
MAPK11 Q15759 3/20 0.30
MAPK14 Q16539 3/20 0.30
HPGD P15428 1/20 0.30
ADORA1 P30542 2/20 0.30
MAOA P21397 1/20 0.30
MAOB P27338 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
SCHEMBL22989067 0.90 L3MBTL1 (0.38) AKT1KDM4EALDH1A1L3MBTL1TDP1
SCHEMBL22989244 0.87 AKT1 (0.38) AKT1PSMB5KDM4EALDH1A1L3MBTL1
SCHEMBL22989059 0.86 LMNA (0.39) AKT1KDM4EALDH1A1L3MBTL1TDP1
SCHEMBL22989065 0.86 MAPK10 (0.38) KDM4EALDH1A1L3MBTL1TDP1LMNA
SCHEMBL22989095 0.86 KDM4E (0.32) AKT1KDM4EL3MBTL1ATMHPGD
SCHEMBL22989063 0.85 LMNA (0.39) AKT1KDM4EALDH1A1L3MBTL1TDP1
SCHEMBL22988979 0.82 MAPK10 (0.35) KDM4EALDH1A1MEN1LMNAKMT2A
SCHEMBL22989194 0.81 MEN1 (0.40) KDM4EALDH1A1L3MBTL1MEN1LMNA
SCHEMBL22989195 0.81 MEN1 (0.36) MEN1KMT2AATMPDE10AHPGD
SCHEMBL22989259 0.81 KDM4E (0.36) AKT1KDM4EALDH1A1L3MBTL1TDP1

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-2021029757-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-02-18 WO disclosed