SCHEMBL16675155

SCHEMBL16675155

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccc(-c5ccc6c(c5)c5ccc7c8ccccc8n(-c8ccccc8)c7c5n6-c5ccccc5)cc4c4ccc5c(c6ccccc6n5-c5ccccc5)c43)n2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ATM Q13315 1/20 0.40
PTGER4 P35408 1/20 0.36
NPY5R Q15761 1/20 0.32
TSPO P30536 1/20 0.31
KMT2A Q03164 2/20 0.31
IL1R1 P14778 1/20 0.31
ABCG2 Q9UNQ0 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CA P42336 1/20 0.31
MTOR P42345 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
HTT P42858 1/20 0.30
RXFP1 Q9HBX9 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
SCHEMBL16675306 0.98 L3MBTL1 (0.40) L3MBTL1KDM4EATMPTGER4NPY5R
SCHEMBL18868035 0.95 L3MBTL1 (0.39) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL23118760 0.95 L3MBTL1 (0.39) L3MBTL1KDM4EATMPTGER4TSPO
SCHEMBL16675148 0.95 KDM4E (0.38) L3MBTL1KDM4EATMPTGER4NPY5R
SCHEMBL16260429 0.94 KDM4E (0.39) L3MBTL1KDM4EATMPTGER4NPY5R
SCHEMBL26473068 0.94 KDM4E (0.39) L3MBTL1KDM4EATMPTGER4NPY5R
SCHEMBL21965498 0.94 L3MBTL1 (0.41) L3MBTL1KDM4EATMPTGER4NPY5R
SCHEMBL21965570 0.94 L3MBTL1 (0.41) L3MBTL1KDM4EATMPTGER4NPY5R
SCHEMBL15197839 0.94 L3MBTL1 (0.41) L3MBTL1KDM4EATMPTGER4NPY5R
SCHEMBL25473876 0.94 L3MBTL1 (0.45) L3MBTL1KDM4EATMPTGER4NPY5R

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-2015060684-A2 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-30 WO disclosed