SCHEMBL3638735

SCHEMBL3638735

Cc1cccc(N(c2ccccc2)c2ccc(-c3c(Nc4ccccc4)ccc(-c4ccc(Nc5ccccc5)cc4)c3-c3ccc(N(c4ccccc4)c4cccc(C)c4)cc3)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.42
HPGD P15428 1/20 0.36
KDR P35968 5/20 0.35
THRB P10828 1/20 0.34
PKM P14618 1/20 0.34
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
FABP3 P05413 1/20 0.32
FABP4 P15090 1/20 0.32
ALDH1A1 P00352 2/20 0.32
AKR1C3 P42330 1/20 0.32
AKR1C2 P52895 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL29402197 1.00 NPSR1 (0.42) NPSR1HPGDKDRTHRBPKM
SCHEMBL17459892 1.00 NPSR1 (0.42) NPSR1HPGDKDRTHRBPKM
SCHEMBL29385958 0.98 NPSR1 (0.39) NPSR1HPGDKDRTHRBPKM
SCHEMBL29353292 0.98 NPSR1 (0.39) NPSR1HPGDKDRTHRBPKM
SCHEMBL15940007 0.98 NPSR1 (0.39) NPSR1HPGDKDRTHRBPKM
SCHEMBL11907121 0.98 NPSR1 (0.39) NPSR1HPGDKDRTHRBPKM
SCHEMBL30451170 0.89 ALDH1A1 (0.38) NPSR1HPGDTHRBHTTL3MBTL1
SCHEMBL1289883 0.87 HPGD (0.44) HPGDKDRFABP3FABP4ALDH1A1
SCHEMBL1289917 0.86 ALDH1A1 (0.34) NPSR1HPGDHTTL3MBTL1ALDH1A1
SCHEMBL29674043 0.85 CNR1 (0.34) FABP3FABP4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2158290-A1 PHOSPHORESCENT OLED HAVING DOUBLE EXCITON-BLOCKING LAYERS EASTMAN KODAK COMPANY (US) 2010-03-03 EP disclosed
WO-2008156554-A1 PHOSPHORESCENT OLED HAVING DOUBLE EXCITON-BLOCKING LAYERS EASTMAN KODAK COMPANY (US) 2008-12-24 WO disclosed