SCHEMBL15085598

SCHEMBL15085598

Cc1cc(Cl)cc(C(=O)NCC2CC2)c1NC(=O)C1CC(c2cc(S(=O)(=O)O)ccn2)=NN1c1ncccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 5/20 0.38
P2RX7 Q99572 1/20 0.37
CHRM1 P11229 3/20 0.36
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM3 P20309 1/20 0.36
DRD4 P21917 1/20 0.34
MAPK14 Q16539 1/20 0.33
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 2/20 0.32
KIF18A Q8NI77 1/20 0.32
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL15085550 0.92 P2RX7 (0.37) MALT1P2RX7CHRM1CHRM2CHRM4
SCHEMBL15085590 0.90 MALT1 (0.39) MALT1DRD4TP53MAPT
SCHEMBL15085529 0.89 P2RX7 (0.38) MALT1P2RX7CHRM1CHRM2CHRM4
SCHEMBL15085649 0.89 P2RX7 (0.38) MALT1P2RX7CHRM1CHRM2CHRM4
SCHEMBL15085620 0.88 MALT1 (0.37) MALT1P2RX7CHRM1CHRM2CHRM4
SCHEMBL15085583 0.87 MALT1 (0.38) MALT1DRD4TP53MAPT
SCHEMBL1149097 0.84 MALT1 (0.42) MALT1P2RX7CHRM1CHRM2CHRM4
SCHEMBL15085543 0.84 MALT1 (0.35) MALT1P2RX7CHRM1CHRM2CHRM4
SCHEMBL1148415 0.84 MALT1 (0.37) MALT1P2RX7CHRM1CHRM2CHRM4
SCHEMBL1148438 0.84 P2RX7 (0.42) MALT1P2RX7CHRM1CHRM2CHRM4

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