SCHEMBL9017615

SCHEMBL9017615

CCCc1c(N)cc(Cl)c(Cl)c1C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 1/20 0.35
POLB P06746 1/20 0.33
RIPK2 O43353 1/20 0.32
LDHA P00338 2/20 0.32
LDHB P07195 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
CYP1A2 P05177 1/20 0.31
GAA P10253 1/20 0.30
IKBKB O14920 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
SCHEMBL4593069 0.87 LMNA (0.38) SIRT1POLBRIPK2LDHALDHB
SCHEMBL9017622 0.87 POLB (0.35) SIRT1POLBRIPK2LMNAHTT
SCHEMBL8732692 0.79 SIRT1 (0.36) SIRT1RIPK2LMNAALDH1A1KMT2A
SCHEMBL9017621 0.79 IKBKB (0.39) POLBRIPK2LMNAHTTIKBKB
SCHEMBL9017628 0.73 POLB (0.37) POLBRIPK2LMNAHTTALDH1A1
SCHEMBL28068800 0.70 POLB (0.39) SIRT1POLBLDHALDHBHTT
SCHEMBL9017596 0.70 IKBKB (0.40) POLBLDHALDHBALDH1A1CYP1A2
SCHEMBL8083612 0.69 GAA (0.34) SIRT1POLBLDHALDHBLMNA
SCHEMBL8732701 0.69 PRKCI (0.39) RIPK2ALDH1A1KMT2AHSD17B10IKBKB
SCHEMBL21236340 0.69 POLB (0.38) SIRT1POLBRIPK2LDHALDHB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0749416-A1 SELECTED BENZAMIDE FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1996-12-27 EP disclosed
WO-1995024380-A1 SELECTED BENZAMIDE FUNGICIDES FOR THE CONTROL OF TAKE-ALL DISEASE OF PLANTS MONSANTO COMPANY (US) 1995-09-14 WO disclosed