SCHEMBL16066641

SCHEMBL16066641

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-n4c5ccccc5c5ccc6c(c7ccccc7c7cc8ccccc8n76)c54)cc3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.35
KDM4E B2RXH2 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KMT2A Q03164 4/20 0.32
RXRA P19793 1/20 0.31
HAO1 Q9UJM8 1/20 0.31
PTGER4 P35408 1/20 0.31
MEN1 O00255 3/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
RAC2 P15153 1/20 0.31
RAC3 P60763 1/20 0.31
CDC42 P60953 1/20 0.31
RAC1 P63000 1/20 0.31
APP P05067 1/20 0.30
NPY5R Q15761 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
RAB9A P51151 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
SCHEMBL16066643 0.99 KDM4E (0.34) ATMKDM4EL3MBTL1KMT2ARXRA
SCHEMBL16066638 0.95 NR3C1 (0.32) ATMKDM4EL3MBTL1NR3C1
SCHEMBL16067044 0.94 ATM (0.36) ATMKDM4EL3MBTL1KMT2ARXRA
SCHEMBL16067048 0.93 ATM (0.35) ATMKDM4EL3MBTL1KMT2ARXRA
SCHEMBL16067187 0.92 ATM (0.36) ATMKDM4EL3MBTL1KMT2ARXRA
SCHEMBL16066660 0.91 PDE10A (0.33) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16066772 0.91 KDM4E (0.33) ATMKDM4EL3MBTL1KMT2AMEN1
SCHEMBL16067185 0.91 ATM (0.35) ATMKDM4EL3MBTL1KMT2ARXRA
SCHEMBL16066652 0.91 KDM4E (0.30) ATMKDM4EL3MBTL1
SCHEMBL16066632 0.89 KDM4E (0.32) ATMKDM4EL3MBTL1KMT2AMEN1

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-2014142488-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT INCLUDING SAME 주식회사 두산 (KR) 2014-09-18 WO disclosed