SCHEMBL12380321

SCHEMBL12380321

CC(C)(C)c1cc2ccc3c(-c4ccccc4)cc(-c4cc(-c5cccc6c5oc5ccccc56)cc(-c5cccc6c5oc5ccccc56)c4)c4ccc(c1)c2c34

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.42
GGPS1 O95749 1/20 0.39
PTGES2 Q9H7Z7 1/20 0.37
CDC14B O60729 2/20 0.35
CDC14A Q9UNH5 2/20 0.35
PRKDC P78527 4/20 0.35
MAPT P10636 2/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP1B1 Q16678 1/20 0.33
CYP17A1 P05093 1/20 0.31
CYP19A1 P11511 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 1/20 0.31
PIK3CD O00329 1/20 0.31
PIK3CB P42338 1/20 0.31
PRMT5 O14744 1/20 0.31
WDR77 Q9BQA1 1/20 0.31
MEN1 O00255 1/20 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
SCHEMBL12380348 0.98 ALOX5 (0.40) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL12380318 0.98 ALOX5 (0.44) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL12380346 0.97 ALOX5 (0.42) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL9920938 0.97 ALOX5 (0.44) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL9920934 0.97 ALOX5 (0.45) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL12380299 0.96 ALOX5 (0.44) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL9921014 0.94 ALOX5 (0.41) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL9920935 0.94 ALOX5 (0.43) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL9920937 0.94 ALOX5 (0.46) ALOX5GGPS1PTGES2CDC14BCDC14A
SCHEMBL12380332 0.94 ALOX5 (0.40) ALOX5GGPS1PTGES2CDC14BCDC14A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8502201-B2 Light-emitting element TORAY INDUSTRIES, INC. (JP) 2013-08-06 US disclosed
US-7989802-B2 Light emitting device material and light emitting device TORAY INDUSTRIES, INC. (JP) 2011-08-02 US disclosed
US-7989802-B2 Light emitting device material and light emitting device TORAY INDUSTRIES, INC. (JP) 2011-08-02 US disclosed
US-20110121268-A1 LIGHT-EMITTING ELEMENT TORAY INDUSTRIES, INC. (JP) 2011-05-26 US disclosed
US-20100038634-A1 LIGHT EMITTING DEVICE MATERIAL AND LIGHT EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2010-02-18 US disclosed
US-20100038634-A1 LIGHT EMITTING DEVICE MATERIAL AND LIGHT EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2010-02-18 US disclosed