SCHEMBL15089115

SCHEMBL15089115

c1ccc(-n2c3ccccc3c3cc4c(cc32)N(c2ccccn2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.43
ALDH1A1 P00352 2/20 0.43
GAA P10253 1/20 0.43
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
HPGD P15428 2/20 0.37
LMNA P02545 2/20 0.37
CASP1 P29466 2/20 0.36
CASP7 P55210 1/20 0.36
PDE6D O43924 1/20 0.36
MAPT P10636 3/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
HBB P68871 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
POLB P06746 4/20 0.34
NPC1 O15118 1/20 0.34
S1PR4 O95977 1/20 0.34

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
SCHEMBL15088906 0.92 KDM4E (0.46) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL15089136 0.90 PDE6D (0.43) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL15089124 0.89 KDM4E (0.40) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089128 0.89 KDM4E (0.40) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL15089111 0.89 KDM4E (0.33) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089153 0.88 KDM4E (0.41) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL15089354 0.88 KDM4E (0.39) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL15089129 0.88 PDE6D (0.34) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089139 0.88 PDE6D (0.38) KDM4EALDH1A1GAAATML3MBTL1
SCHEMBL15089116 0.88 SMN1; SMN2 (0.38) KDM4EALDH1A1GAAATML3MBTL1

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-2013100497-A1 ORGANIC LIGHT-EMITTING COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME 주식회사 두산 (KR) 2013-07-04 WO disclosed