SCHEMBL28093056

SCHEMBL28093056

O=C(Nc1ccc(Cl)c(Cl)c1)c1ccccc1O

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.72
PLA2G10 O15496 1/20 0.72
PHGDH O43175 1/20 0.72
F2 P00734 1/20 0.72
CA2 P00918 1/20 0.72
PLA2G1B P04054 1/20 0.72
ARG1 P05089 1/20 0.72
LCK P06239 1/20 0.72
HTR1A P08908 1/20 0.72
CHRM1 P11229 1/20 0.72
ACE P12821 1/20 0.72
PLA2G2A P14555 1/20 0.72
GABRA1 P14867 1/20 0.72
IDO1 P14902 1/20 0.72
MAOA P21397 1/20 0.72
CNR1 P21554 1/20 0.72
ACHE P22303 1/20 0.72
PLA2G5 P39877 1/20 0.72
GABRB2 P47870 1/20 0.72
PPARA Q07869 1/20 0.72

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
SCHEMBL1514327 0.92 PLA2G10 (0.79) PTGS1PLA2G10PHGDHF2CA2
SCHEMBL11786428 0.90 FADS1 (0.68) PTGS1PLA2G10PHGDHF2CA2
SCHEMBL1514811 0.89 PLA2G10 (0.75) PTGS1PLA2G10PHGDHF2CA2
SCHEMBL4254011 0.87 RAB9A (0.68) PTGS1PNLIPNPC1RAB9AMEN1
SCHEMBL16941521 0.86 LMNA (0.63) PTGS1PLA2G10PHGDHF2CA2
SCHEMBL12163163 0.86 FADS1 (0.72) PTGS1PLA2G10PHGDHF2CA2
Triclocarban SCHEMBL20898542 0.86 MEN1 (0.62) PTGS1PLA2G10PHGDHF2CA2
SCHEMBL240964 0.85 FADS1 (0.65) PTGS1PLA2G10PHGDHF2CA2
SCHEMBL11594877 0.85 DHODH (0.72) PTGS1PLA2G10PHGDHF2CA2
SCHEMBL29601056 0.85 FADS1 (0.65) PTGS1PLA2G10PHGDHF2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105911162-B The assay method of bromo and Chlorosalicylic anilide in a kind of cosmetics 中国检验检疫科学研究院 2018-01-26 CN claimed
CN-105911162-A Method for determining brominated and chlorinated salicylanilide in cosmetics 中国检验检疫科学研究院 2016-08-31 CN claimed
CN-105911162-B The assay method of bromo and Chlorosalicylic anilide in a kind of cosmetics 中国检验检疫科学研究院 2018-01-26 CN disclosed
CN-105911162-A Method for determining brominated and chlorinated salicylanilide in cosmetics 中国检验检疫科学研究院 2016-08-31 CN disclosed