SCHEMBL15089294

SCHEMBL15089294

Cc1ccnc(N2c3cc4c(cc3-c3cccc5cccc2c35)c2cc(-c3ccccc3)ccc2n4-c2cc(C)ccn2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GLA P06280 1/20 0.39
PDE6D O43924 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
RAB9A P51151 2/20 0.35
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.35
S1PR4 O95977 1/20 0.35
PABPC1 P11940 1/20 0.35
S1PR1 P21453 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
DPP4 P27487 1/20 0.33
NPC1 O15118 1/20 0.30
PKM P14618 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
SCHEMBL15089204 0.94 PDE6D (0.38) ALDH1A1LMNAMAPTKDM4EGLA
SCHEMBL15089286 0.92 PDE6D (0.40) ALDH1A1KDM4EPDE6DGAA
SCHEMBL15089356 0.90 PDE6D (0.34) ALDH1A1LMNAMAPTKDM4EGLA
SCHEMBL15089036 0.90 ALDH1A1 (0.35) ALDH1A1LMNAMAPTKDM4EGLA
SCHEMBL15088896 0.89 SMN1; SMN2 (0.40) ALDH1A1LMNAMAPTKDM4EGLA
SCHEMBL15089168 0.87 PDE6D (0.41) ALDH1A1KDM4EPDE6DGAA
SCHEMBL15088915 0.86 PDE6D (0.37) ALDH1A1LMNAKDM4EPDE6DGAA
SCHEMBL15089293 0.86 PDE6D (0.42) ALDH1A1LMNAMAPTKDM4EPDE6D
SCHEMBL15089026 0.86 PDE6D (0.35) ALDH1A1LMNAKDM4EPDE6DGAA
SCHEMBL15089361 0.86 PDE6D (0.35) ALDH1A1LMNAKDM4EPDE6DGAA

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