SCHEMBL15089157

SCHEMBL15089157

c1ccc(-c2ccc3c(c2)c2cc4c(cc2n3-c2ccccn2)N(c2ccc(-c3cccnc3)cn2)c2cccc3cccc-4c23)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.36
KDM4E B2RXH2 2/20 0.35
GAA P10253 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP11B1 P15538 3/20 0.33
CYP11B2 P19099 2/20 0.33
CYP17A1 P05093 1/20 0.33
CYP19A1 P11511 1/20 0.33
VHL P40337 1/20 0.33
LMNA P02545 2/20 0.33
HRH1 P35367 1/20 0.33
HTR6 P50406 1/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
G6PD P11413 1/20 0.32
CYP2A6 P11509 1/20 0.32
PIK3CA P42336 1/20 0.31
ATM Q13315 1/20 0.31
MAPT P10636 2/20 0.31

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
SCHEMBL15089268 0.97 PDE6D (0.36) PDE6DALDH1A1CYP11B1CYP11B2CYP17A1
SCHEMBL15089240 0.93 MAPT (0.36) PDE6DKDM4EGAAALDH1A1CYP11B1
SCHEMBL15089140 0.93 KDM4E (0.36) PDE6DKDM4EGAAALDH1A1CYP11B1
SCHEMBL15089072 0.92 MAPT (0.37) PDE6DKDM4EGAAALDH1A1CYP11B1
SCHEMBL15089293 0.91 PDE6D (0.42) PDE6DKDM4EGAAALDH1A1LMNA
SCHEMBL15089160 0.91 PDE6D (0.39) PDE6DKDM4EGAAALDH1A1LMNA
SCHEMBL15088899 0.89 CYP11B1 (0.36) PDE6DKDM4EGAAALDH1A1CYP11B1
SCHEMBL15088815 0.89 PIK3CA (0.36) PDE6DALDH1A1CYP11B1CYP11B2CYP17A1
SCHEMBL15089267 0.89 PDE6D (0.38) PDE6DKDM4EGAAALDH1A1LMNA
SCHEMBL15088834 0.88 PIK3CA (0.37) ALDH1A1CYP11B1CYP11B2CYP17A1CYP19A1

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