SCHEMBL17033720

SCHEMBL17033720

c1ccc(-c2cc(-c3ccccc3)nc(-c3cccc(-n4c5ccccc5c5ccc6c(nc7c8ccccc8c8ccccc8n67)c54)c3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.34
KMT2A Q03164 6/20 0.34
ALDH1A1 P00352 5/20 0.34
MAPT P10636 5/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 4/20 0.34
LMNA P02545 3/20 0.34
GAA P10253 2/20 0.33
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
POLB P06746 2/20 0.31
NTSR1 P30989 1/20 0.31
PIK3CA P42336 1/20 0.31
MTOR P42345 1/20 0.31
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
GLA P06280 1/20 0.30
NPC1 O15118 1/20 0.30
TSHR P16473 1/20 0.30
ALOX12 P18054 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
SCHEMBL17033697 0.94 GAA (0.34) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17033722 0.92 MEN1 (0.33) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17033699 0.91 MEN1 (0.33) MEN1KMT2AALDH1A1KDM4EHPGD
SCHEMBL17033678 0.90 GAA (0.36) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17033700 0.90 GAA (0.33) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17033705 0.86 KDM4E (0.33) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17033509 0.85 KDM4E (0.39) MEN1KMT2AALDH1A1KDM4EGAA
SCHEMBL17033688 0.85 MAPT (0.39) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17033435 0.85 KMT2A (0.37) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL17033676 0.85 KDM4E (0.34) MEN1KMT2AALDH1A1KDM4EHPGD

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-2015125986-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-08-27 WO disclosed