SCHEMBL4306906

SCHEMBL4306906

CC(C)(C)c1ccc2c(-c3cc4ccccc4c4ccccc34)c3ccccc3c(-c3cc4ccccc4c4ccccc34)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.44
KIF11 P52732 3/20 0.44
TRPM4 Q8TD43 1/20 0.40
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NPC1 O15118 1/20 0.39
PLA2G1B P04054 1/20 0.39
NFKB1 P19838 1/20 0.39
CASP3 P42574 1/20 0.39
RAB9A P51151 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
ATG4B Q9Y4P1 1/20 0.39
HPRT1 P00492 1/20 0.38
SOS1 Q07889 1/20 0.37
HIF1A Q16665 3/20 0.37
HPGD P15428 2/20 0.37

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
SCHEMBL26214203 0.88 GPR84 (0.49) GPR84KIF11ALDH1A1L3MBTL1HPRT1
SCHEMBL13319789 0.87 PGR (0.38) GPR84KIF11TRPM4ALDH1A1L3MBTL1
SCHEMBL26216554 0.85 GPR84 (0.52) GPR84KIF11TRPM4ALDH1A1L3MBTL1
SCHEMBL26217141 0.85 GPR84 (0.47) GPR84KIF11SOS1CYP11B1LMNA
SCHEMBL12203323 0.83 ALOX5 (0.40) GPR84KIF11ALDH1A1L3MBTL1HIF1A
SCHEMBL5050124 0.83 KIF11 (0.44) GPR84KIF11ALDH1A1L3MBTL1NPC1
SCHEMBL2380338 0.83 KIF11 (0.44) GPR84KIF11ALDH1A1L3MBTL1NPC1
SCHEMBL261638 0.83 KIF11 (0.44) GPR84KIF11ALDH1A1L3MBTL1NPC1
SCHEMBL29416697 0.83 KIF11 (0.44) GPR84KIF11ALDH1A1L3MBTL1NPC1
SCHEMBL12203326 0.83 GPR84 (0.41) GPR84KIF11ALDH1A1NPC1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504163-B2 Hole-trapping materials for improved OLED efficiency EASTMAN KODAK COMPANY (US) 2009-03-17 US disclosed
US-20070126347-A1 OLEDS with improved efficiency EASTMAN KODAK COMPANY 2007-06-07 US disclosed
US-20060008672-A1 Hole-trapping materials for improved OLED efficiency EASTMAN KODAK COMPANY 2006-01-12 US disclosed