SCHEMBL15085560

SCHEMBL15085560

CNC(=O)c1cc(C#N)cc(C)c1NC(=O)C1CC(c2cc([N+](=O)[O-])ccc2S(=O)(=O)O)=NN1c1ncccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.32
MALT1 Q9UDY8 2/20 0.32
NPC1 O15118 1/20 0.32
HTT P42858 1/20 0.32
RAB9A P51151 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
RORC P51449 1/20 0.32
TP53 P04637 1/20 0.31
GRM5 P41594 1/20 0.31
EPHX2 P34913 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
SCHEMBL15085596 0.93 MALT1 (0.35) SMN1; SMN2MALT1NPC1HTTRAB9A
SCHEMBL15085532 0.91 MALT1 (0.32) MALT1MAPTTP53GRM5
SCHEMBL15085579 0.89 GRM5 (0.35) MALT1ALDH1A1MAPTTP53GRM5
SCHEMBL15085554 0.87 MALT1 (0.35) MALT1KMT2AMAPTTP53
SCHEMBL15085539 0.87 MALT1 (0.35) MALT1KMT2A
SCHEMBL1148188 0.85 GPR17 (0.33) SMN1; SMN2MALT1NPC1HTTRAB9A
SCHEMBL15085535 0.85 MALT1 (0.34) SMN1; SMN2MALT1NPC1HTTRAB9A
SCHEMBL15085562 0.84 MALT1 (0.34) SMN1; SMN2MALT1NPC1HTTRAB9A
SCHEMBL1148615 0.83 F2 (0.35) SMN1; SMN2MALT1NPC1HTTRAB9A
SCHEMBL15085542 0.83 MALT1 (0.35) MALT1L3MBTL1ALDH1A1MEN1KMT2A

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
US-8481744-B2 Process for producing anthranilamide compound ISHIHARA SANGYO KAISHA, LTD. (JP) 2013-07-09 US disclosed