SCHEMBL16482292

SCHEMBL16482292

c1ccc(-c2cccc(-n3c4ccc5c6ccccc6sc5c4c4cccc(-n5c6ccccc6c6ccccc65)c43)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TNKS O95271 1/20 0.36
TNKS2 Q9H2K2 1/20 0.36
ALOX5 P09917 1/20 0.34
MAPT P10636 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TP53 P04637 1/20 0.32
PRKDC P78527 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL16482499 0.99 TNKS (0.36) TNKSTNKS2ALOX5MAPTRXFP1
SCHEMBL16482175 0.94 LIMK1 (0.33) TNKSTNKS2ALOX5MAPTRXFP1
SCHEMBL16482226 0.93 ALOX5 (0.34) TNKSTNKS2ALOX5MAPTRXFP1
SCHEMBL16482158 0.93 ALOX5 (0.43) TNKSTNKS2ALOX5MAPTRXFP1
SCHEMBL16482494 0.93 TNKS (0.36) TNKSTNKS2ALOX5KDM4EATM
SCHEMBL16482334 0.91 TNKS (0.35) TNKSTNKS2ALOX5KDM4EATM
SCHEMBL16482393 0.91 ATM (0.41) TNKSTNKS2ALOX5MAPTRXFP1
SCHEMBL16482155 0.91 KDM4E (0.35) TNKSTNKS2ALOX5KDM4EATM
SCHEMBL16482497 0.91 TNKS (0.36) TNKSTNKS2ALOX5KDM4EATM
SCHEMBL16482248 0.90 TNKS (0.33) TNKSTNKS2ALOX5PRKDC

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