SCHEMBL15085543

SCHEMBL15085543

Cc1cc(Cl)cc(C(=O)NCC2CC2)c1NC(=O)C1CC(c2c([N+](=O)[O-])cccc2S(=O)(=O)O)=NN1c1ncccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 4/20 0.35
P2RX7 Q99572 1/20 0.34
F10 P00742 1/20 0.34
CTSB P07858 2/20 0.33
CTSL P07711 1/20 0.33
MAPT P10636 4/20 0.33
TP53 P04637 2/20 0.33
NPY5R Q15761 2/20 0.32
HTT P42858 2/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
CHRM1 P11229 2/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM3 P20309 1/20 0.31
KMT2A Q03164 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
SCHEMBL15085580 0.93 P2RX7 (0.34) MALT1P2RX7F10CTSBCTSL
SCHEMBL15085544 0.92 P2RX7 (0.35) MALT1P2RX7F10CTSBCTSL
SCHEMBL15085585 0.91 MALT1 (0.35) MALT1MAPTTP53ALDH1A1KMT2A
SCHEMBL15085566 0.90 F10 (0.37) MALT1P2RX7F10CTSBCTSL
SCHEMBL15085535 0.89 MALT1 (0.34) MALT1P2RX7MAPTHTTALDH1A1
SCHEMBL15085620 0.89 MALT1 (0.37) MALT1P2RX7MAPTTP53HTT
SCHEMBL15085622 0.88 MALT1 (0.34) MALT1MAPTTP53ALDH1A1MAPK1
SCHEMBL1148237 0.88 F2 (0.36) MALT1P2RX7F10CTSBCTSL
SCHEMBL15085649 0.86 P2RX7 (0.38) MALT1P2RX7MAPTTP53HTT
SCHEMBL15085667 0.84 P2RX7 (0.35) MALT1P2RX7F10CTSBCTSL

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