SCHEMBL15088980

SCHEMBL15088980

CC1(C)c2ccccc2-c2cc3c(cc21)N(c1cccc(-c2ccccc2)c1)c1cccc2cccc-3c12

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE6D O43924 1/20 0.43
PGR P06401 5/20 0.36
FAAH O00519 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSP90AA1 P07900 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
ATM Q13315 1/20 0.35
MGLL Q99685 1/20 0.35
MEN1 O00255 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
SCHEMBL15089064 0.94 PDE6D (0.39) PDE6DPGR
SCHEMBL15089088 0.93 PDE6D (0.43) PDE6DPGRMEN1KMT2A
SCHEMBL15088990 0.92 PDE6D (0.52) PDE6DPGRALDH1A1MEN1KMT2A
SCHEMBL15088985 0.92 PDE6D (0.41) PDE6DPGRALDH1A1HTTATM
SCHEMBL15089089 0.88 PDE6D (0.37) PDE6DPGR
SCHEMBL15088981 0.88 PDE6D (0.35) PDE6DPGRATM
SCHEMBL15088988 0.84 PDE6D (0.37) PDE6DALDH1A1
SCHEMBL15088796 0.84 PDE6D (0.38) PDE6DPGR
SCHEMBL15089001 0.83 PDE6D (0.37) PDE6DALDH1A1
SCHEMBL15088979 0.83 ALDH1A1 (0.41) PDE6DPGRALDH1A1MEN1KMT2A

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