SCHEMBL8994492

SCHEMBL8994492

Cn1c(Cl)c(C#N)c(Br)c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.46
AHR P35869 4/20 0.39
AR P10275 2/20 0.38
KMO O15229 2/20 0.38
ADORA2A P29274 2/20 0.37
ADORA1 P30542 1/20 0.37
IDO1 P14902 1/20 0.36
HSD11B1 P28845 1/20 0.36
ALOX15 P16050 2/20 0.36
CYP1B1 Q16678 1/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
NFKB1 P19838 1/20 0.35
RAB9A P51151 1/20 0.35
NFKB2 Q00653 1/20 0.35
KMT2A Q03164 1/20 0.35
RELA Q04206 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL9224323 0.84 MAPK14 (0.40) MAPK14AHRARKMOADORA2A
SCHEMBL8994490 0.83 MAPK14 (0.42) MAPK14AHRKMOADORA2AADORA1
SCHEMBL27260508 0.76 AHR (0.41) MAPK14AHRARKMOADORA2A
SCHEMBL9019133 0.76 MAPK14 (0.41) MAPK14AHRARKMOADORA2A
SCHEMBL9019071 0.76 MAOB (0.39) MAPK14AHRKMOADORA2AADORA1
SCHEMBL9019167 0.75 MAPK14 (0.40) MAPK14AHRARKMOADORA2A
SCHEMBL9058962 0.74 P2RX3 (0.37) MAPK14IDO1MEN1KMT2A
SCHEMBL9519227 0.73 GRIA2 (0.42) ARADORA2AADORA1ALOX15ALDH1A1
SCHEMBL9222935 0.72 AHR (0.39) MAPK14AHRKMOADORA2AADORA1
SCHEMBL9019068 0.72 MAPT (0.38) MAPK14AHRKMOADORA2AADORA1

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
EP-0594941-B1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed