SCHEMBL16675148

SCHEMBL16675148

c1ccc(-c2nc(-c3ccccc3)nc(-n3c4ccccc4c4cc(-n5c6ccc(-c7ccc8c(c7)c7ccc9c%10ccccc%10n(-c%10ccccc%10)c9c7n8-c7ccccc7)cc6c6ccc7c(c8ccccc8n7-c7ccccc7)c65)ccc43)n2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
PTGER4 P35408 1/20 0.35
RAC2 P15153 1/20 0.33
RAC3 P60763 1/20 0.33
CDC42 P60953 1/20 0.33
RAC1 P63000 1/20 0.33
NPY5R Q15761 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
NR3C1 P04150 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
SCHEMBL26472820 0.96 KDM4E (0.39) KDM4EATML3MBTL1PTGER4RAC2
SCHEMBL16260429 0.96 KDM4E (0.39) KDM4EATML3MBTL1PTGER4RAC2
SCHEMBL16260424 0.96 L3MBTL1 (0.41) KDM4EATML3MBTL1PTGER4RAC2
SCHEMBL2741484 0.96 L3MBTL1 (0.41) KDM4EATML3MBTL1PTGER4RAC2
SCHEMBL27044301 0.95 KDM4E (0.37) KDM4EATML3MBTL1PTGER4RAC2
SCHEMBL26473080 0.95 KDM4E (0.38) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL16260431 0.95 KDM4E (0.38) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL16675155 0.95 L3MBTL1 (0.40) KDM4EATML3MBTL1PTGER4NPY5R
SCHEMBL20251799 0.94 L3MBTL1 (0.41) KDM4EATML3MBTL1PTGER4RAC2
SCHEMBL20251821 0.94 L3MBTL1 (0.41) KDM4EATML3MBTL1PTGER4RAC2

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