SCHEMBL15085585

SCHEMBL15085585

CNC(=O)c1cc(Cl)cc(C)c1NC(=O)C1CC(c2c([N+](=O)[O-])cccc2S(=O)(=O)O)=NN1c1ncccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 5/20 0.35
MAPT P10636 2/20 0.33
TP53 P04637 1/20 0.33
GRM5 P41594 1/20 0.32
ALDH1A1 P00352 4/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
DHODH Q02127 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
HCRTR1 O43613 1/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
POLB P06746 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
SCHEMBL15085579 0.93 GRM5 (0.35) MALT1MAPTTP53GRM5ALDH1A1
SCHEMBL15085542 0.91 MALT1 (0.35) MALT1MAPTTP53ALDH1A1KMT2A
SCHEMBL15085543 0.91 MALT1 (0.35) MALT1MAPTTP53ALDH1A1KMT2A
SCHEMBL15085622 0.90 MALT1 (0.34) MALT1MAPTTP53ALDH1A1SMN1; SMN2
SCHEMBL15085596 0.89 MALT1 (0.35) MALT1MAPTTP53ALDH1A1SMN1; SMN2
SCHEMBL15085604 0.88 MALT1 (0.38) MALT1MAPTTP53KMT2AHCRTR1
SCHEMBL1148390 0.87 MALT1 (0.36) MALT1MAPTTP53ALDH1A1SMN1; SMN2
SCHEMBL15085532 0.84 MALT1 (0.32) MALT1MAPTTP53GRM5
SCHEMBL15085588 0.84 MALT1 (0.39) MALT1MAPTTP53
SCHEMBL15085581 0.83 MALT1 (0.32) MALT1

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