SCHEMBL18935409

SCHEMBL18935409

c1ccc(-c2cc(-c3ccc(-c4nc5ccccc5c5ccccc45)cc3)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
ATM Q13315 1/20 0.58
NUDT1 P36639 3/20 0.45
ADORA2A P29274 1/20 0.45
DHODH Q02127 2/20 0.44
WHR1 P49842 1/20 0.43
GAA P10253 2/20 0.42
KDM4E B2RXH2 2/20 0.42
LMNA P02545 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
PDE5A O76074 1/20 0.41
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
ABCG2 Q9UNQ0 3/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL18935399 1.00 MEN1 (0.58) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18935407 0.97 MEN1 (0.55) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18935003 0.95 MEN1 (0.51) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18935406 0.94 MEN1 (0.52) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18935411 0.93 TDP1 (0.55) MEN1KMT2AATMADORA2ADHODH
SCHEMBL18935408 0.93 MEN1 (0.51) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL19009488 0.92 MEN1 (0.67) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18935397 0.92 MEN1 (0.50) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18935398 0.92 MEN1 (0.50) MEN1KMT2AATMNUDT1ADORA2A
SCHEMBL18935315 0.91 MEN1 (0.49) MEN1KMT2AATMNUDT1ADORA2A

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-2017095100-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME 주식회사 두산 2017-06-08 WO disclosed