SCHEMBL12380245

SCHEMBL12380245

c1ccc2cc(-c3ccc4ccc5c(-c6ccc7ccccc7c6)cc(-c6ccc(-c7cccc8c7oc7ccccc78)cc6)c6ccc3c4c65)ccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.51
PRKDC P78527 6/20 0.41
GGPS1 O95749 1/20 0.39
PTGES2 Q9H7Z7 1/20 0.37
CYP1A1 P04798 1/20 0.36
CYP1B1 Q16678 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
GSTP1 P09211 1/20 0.34
CYP1A2 P05177 2/20 0.34
NPC1 O15118 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34
CDC14B O60729 2/20 0.33
CDC14A Q9UNH5 2/20 0.33
ERBB2 P04626 1/20 0.33
FYN P06241 1/20 0.33
MAOA P21397 1/20 0.33
ACHE P22303 1/20 0.33

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
SCHEMBL12380258 0.96 ALOX5 (0.50) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL12380125 0.96 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL1687978 0.96 ALOX5 (0.54) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL9920848 0.95 ALOX5 (0.48) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL15446759 0.95 ALOX5 (0.53) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL12380340 0.95 ALOX5 (0.56) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL9920800 0.94 ALOX5 (0.57) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL23109648 0.93 ALOX5 (0.48) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL12613009 0.93 ALOX5 (0.50) ALOX5PRKDCGGPS1PTGES2CYP1A1
SCHEMBL12380186 0.93 ALOX5 (0.53) ALOX5PRKDCGGPS1PTGES2CYP1A1

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 9 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-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-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
EP-2128217-A1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE Toray Industries, Inc. (JP) 2009-12-02 EP disclosed