SCHEMBL9019133

SCHEMBL9019133

N#Cc1c(Br)c(Br)n(O)c1-c1ccc(Cl)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.41
AHR P35869 4/20 0.37
KMO O15229 2/20 0.36
MAOA P21397 3/20 0.35
MAOB P27338 3/20 0.35
IDO1 P14902 1/20 0.35
POLB P06746 1/20 0.35
HTT P42858 1/20 0.35
AR P10275 1/20 0.34
ADORA2A P29274 2/20 0.33
ADORA1 P30542 1/20 0.33
CYP1B1 Q16678 1/20 0.33
MET P08581 1/20 0.32
KDR P35968 1/20 0.32
ALOX15 P16050 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
LMNA P02545 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
SCHEMBL9019044 0.83 MAOA (0.38) MAOAMAOBPOLBHTTALOX15
SCHEMBL9019167 0.82 MAPK14 (0.40) MAPK14AHRKMOIDO1POLB
SCHEMBL9019071 0.79 MAOB (0.39) MAPK14AHRKMOMAOAMAOB
SCHEMBL8994492 0.76 MAPK14 (0.46) MAPK14AHRKMOMAOAIDO1
SCHEMBL8994490 0.75 MAPK14 (0.42) MAPK14AHRKMOIDO1ADORA2A
SCHEMBL9023409 0.74 CCR2 (0.46) MAPK14AHRKMOMAOAMAOB
SCHEMBL27260508 0.68 AHR (0.41) MAPK14AHRKMOIDO1AR
SCHEMBL10591229 0.67 MAPK14 (0.43) MAPK14AHRKMOIDO1ADORA2A
SCHEMBL9224323 0.67 MAPK14 (0.40) MAPK14AHRKMOMAOAIDO1
SCHEMBL9316192 0.67 AHR (0.39) MAPK14AHRKMOMAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434940-B1 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID CO (US) 1996-05-29 EP claimed
US-5102904-A N-OXYGENATED ARYLPYRROLE INSECTICIDAL, ACARICIDAL AND NEMATICIDAL AGENTS AND USE THEREAS AMERICAN CYANAMID COMPANY (US) 1992-04-07 US claimed
EP-0434940-A2 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1991-07-03 EP claimed