SCHEMBL17033865

SCHEMBL17033865

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-n4c5ccccc5c5c6cc7c8ccccc8c8ccccc8n7c6ccc54)n3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
MAPT P10636 2/20 0.33
ATM Q13315 2/20 0.33
KDM4E B2RXH2 4/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
TSPO P30536 1/20 0.32
LMNA P02545 2/20 0.31
USP2 O75604 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TUBB4A P04350 1/20 0.31
TUBB P07437 1/20 0.31
TUBA3C P0DPH7 1/20 0.31
TUBA1B P68363 1/20 0.31
TUBA4A P68366 1/20 0.31

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
SCHEMBL17033787 0.97 KDM4E (0.33) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL17033809 0.93 KDM4E (0.31) ATMKDM4ETSHRHSD17B10L3MBTL1
SCHEMBL17033797 0.91 ATM (0.41) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL17033796 0.90 BMX (0.35) MEN1KMT2AMAPTATMKDM4E
SCHEMBL17033807 0.90 ATM (0.41) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL17033812 0.89 MAPT (0.34) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL17033859 0.87 KDM4E (0.37) KMT2AATMKDM4EL3MBTL1TSPO
SCHEMBL17033844 0.87 MEN1 (0.31) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL17033798 0.86 DHODH (0.35) KMT2AALDH1A1MAPTKDM4ETSHR
SCHEMBL17033505 0.86 NPY5R (0.35) MEN1KMT2AALDH1A1HPGDMAPT

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