SCHEMBL16482115

SCHEMBL16482115

c1ccc(-c2ccc3sc4c(ccc5c4c4cc(-n6c7ccccc7c7ccccc76)ccc4n5-c4cccc5c4sc4ccccc45)c3c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.34
LIMK1 P53667 1/20 0.33
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PRKDC P78527 1/20 0.32
TSPO P30536 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PIM3 Q86V86 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
SCHEMBL16482053 0.95 ALOX5 (0.34) ALOX5LIMK1TNKSTNKS2PRKDC
SCHEMBL16482117 0.93 LIMK1 (0.36) ALOX5LIMK1TNKSTNKS2TSPO
SCHEMBL16482247 0.91 LIMK1 (0.32) LIMK1TSPOKDM4EATML3MBTL1
SCHEMBL16482254 0.91 LIMK1 (0.33) ALOX5LIMK1PRKDCTSPOKDM4E
SCHEMBL16482093 0.91 KDM4E (0.39) LIMK1TSPOKDM4EATML3MBTL1
SCHEMBL16482211 0.91 ALOX5 (0.35) ALOX5TNKSTNKS2PRKDCKDM4E
SCHEMBL16482178 0.90 TNKS (0.36) ALOX5LIMK1TNKSTNKS2PRKDC
SCHEMBL16482350 0.90 ALOX5 (0.34) ALOX5LIMK1TNKSTNKS2KDM4E
SCHEMBL17057285 0.90 LIMK1 (0.36) ALOX5LIMK1TNKSTNKS2TSPO
SCHEMBL16482091 0.90 L3MBTL1 (0.41) LIMK1TSPOKDM4EATML3MBTL1

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-2014057659-A1 COMPOUND, AND ORGANIC ELECTROLUMINESCENT ELEMENT PRODUCED USING SAME 出光興産株式会社 (JP) 2014-04-17 WO disclosed