SCHEMBL16482117

SCHEMBL16482117

c1ccc(-c2ccc3sc4c(ccc5c4c4cc(-n6c7ccccc7c7ccccc76)ccc4n5-c4ccc5sc6ccccc6c5c4)c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 2/20 0.36
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TSPO P30536 1/20 0.33
PIM3 Q86V86 2/20 0.33
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
ALOX5 P09917 1/20 0.33
HDAC4 P56524 1/20 0.31
GPR3 P46089 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PIM1 P11309 1/20 0.30
PIM2 Q9P1W9 1/20 0.30
CYP1A2 P05177 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
SCHEMBL16482093 0.95 KDM4E (0.39) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL16482350 0.94 ALOX5 (0.34) LIMK1KDM4EATML3MBTL1PIM3
SCHEMBL16482091 0.94 L3MBTL1 (0.41) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL16482347 0.93 L3MBTL1 (0.40) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL16482364 0.93 L3MBTL1 (0.41) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL24676629 0.93 L3MBTL1 (0.41) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL16482115 0.93 ALOX5 (0.34) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL16482493 0.92 KDM4E (0.38) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL19652785 0.92 KDM4E (0.40) LIMK1KDM4EATML3MBTL1TSPO
SCHEMBL16482298 0.92 GPR3 (0.37) KDM4EATML3MBTL1ALOX5GPR3

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