SCHEMBL16482158

SCHEMBL16482158

c1cc(-c2cccc3c2sc2ccccc23)cc(-n2c3ccc4c5ccccc5sc4c3c3cccc(-n4c5ccccc5c5ccccc54)c32)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
PRKDC P78527 3/20 0.38
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
MAPT P10636 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PARP14 Q460N5 1/20 0.32
TP53 P04637 1/20 0.31
PIK3CD O00329 1/20 0.31
BRD4 O60885 1/20 0.31
PIK3CA P42336 1/20 0.31
PIK3CB P42338 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31
KCNH2 Q12809 1/20 0.31
BRDT Q58F21 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
SCHEMBL16482292 0.93 TNKS (0.36) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL16482499 0.92 TNKS (0.36) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL18589621 0.90 ALOX5 (0.43) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL18589602 0.90 ALOX5 (0.43) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL16482226 0.90 ALOX5 (0.34) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL16482193 0.89 ALOX5 (0.42) ALOX5PRKDCTNKSTNKS2PARP14
SCHEMBL18589570 0.89 ALOX5 (0.43) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL16171138 0.89 ALOX5 (0.48) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL16482262 0.88 ALOX5 (0.45) ALOX5PRKDCTNKSTNKS2MAPT
SCHEMBL16484394 0.88 ALOX5 (0.47) ALOX5PRKDCTNKSTNKS2MAPT

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