SCHEMBL16482091

SCHEMBL16482091

c1ccc(-c2ccc3sc4c(ccc5c4c4cc(-n6c7ccccc7c7ccccc76)ccc4n5-c4ccccc4)c3c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
LIMK1 P53667 2/20 0.36
TSPO P30536 1/20 0.34
HDAC4 P56524 1/20 0.34
JAK2 O60674 1/20 0.33
JAK3 P52333 1/20 0.33
KMT2A Q03164 2/20 0.32
IL1R1 P14778 1/20 0.32
PIM3 Q86V86 2/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
PIM1 P11309 1/20 0.31
PIM2 Q9P1W9 1/20 0.31
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30
HSD17B10 Q99714 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 0.99 KDM4E (0.39) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL16482092 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL16482117 0.94 LIMK1 (0.36) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL16482347 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL24676585 0.94 L3MBTL1 (0.41) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL16482113 0.93 KDM4E (0.38) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL14951774 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL15003586 0.93 LIMK1 (0.40) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL9890496 0.92 L3MBTL1 (0.40) L3MBTL1KDM4EATMLIMK1TSPO
SCHEMBL15137668 0.92 L3MBTL1 (0.42) L3MBTL1KDM4EATMLIMK1TSPO

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