SCHEMBL16613305

SCHEMBL16613305

c1ccc(-c2nc(-n3c4ccccc4c4c5ccccc5ccc43)nc3ccoc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.36
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 4/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MAPT P10636 2/20 0.36
PIK3CD O00329 1/20 0.36
PIK3CA P42336 1/20 0.36
L3MBTL1 Q9Y468 3/20 0.35
LMNA P02545 1/20 0.34
RORC P51449 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
GPR55 Q9Y2T6 1/20 0.31
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 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
SCHEMBL16613306 0.98 ALDH1A1 (0.35) HPGDALDH1A1KDM4ENPSR1MAPT
SCHEMBL16613398 0.93 PIK3CD (0.34) HPGDALDH1A1KDM4ENPSR1MAPT
SCHEMBL16613375 0.91 KDM4E (0.32) HPGDALDH1A1KDM4ENPSR1MAPT
SCHEMBL16613376 0.88 PIK3CD (0.32) HPGDALDH1A1KDM4EMAPTPIK3CD
SCHEMBL16613307 0.88 BRD4 (0.34) HPGDALDH1A1KDM4EMAPTPIK3CD
SCHEMBL16613768 0.88 HPGD (0.43) HPGDALDH1A1KDM4ENPSR1MAPT
SCHEMBL16613374 0.87 PIK3CD (0.31) HPGDALDH1A1KDM4EMAPTPIK3CD
SCHEMBL16613389 0.85 PIK3CD (0.30) PIK3CDPIK3CARORC
SCHEMBL16785752 0.85 ALDH1A1 (0.51) HPGDALDH1A1KDM4ENPSR1MAPT
SCHEMBL16613671 0.85 HPGD (0.41) HPGDALDH1A1KDM4ENPSR1MAPT

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-2015047058-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2015-04-02 WO disclosed