SCHEMBL5716655

SCHEMBL5716655

CSCC(NC(=O)c1c(F)cccc1C(=O)O)(S(C)(=O)=O)S(C)(=O)=O

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALB P02768 1/20 0.36
ALOX15 P16050 1/20 0.34
HPGD P15428 1/20 0.34
KAT6A Q92794 5/20 0.33
KMT2A Q03164 3/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PTPN1 P18031 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
HTT P42858 1/20 0.32
ITGB2 P05107 1/20 0.32
ICAM1 P05362 1/20 0.32
ITGAL P20701 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
SCHEMBL5716656 0.91 PTPN1 (0.40) ALBHPGDKAT6AKMT2ANPC1
SCHEMBL550487 0.83 ALB (0.40) ALBALOX15KMT2ANPC1RAB9A
SCHEMBL550488 0.73 PTPN1 (0.42) ALBKMT2ANPC1RAB9APTPN1
SCHEMBL27705157 0.71 ALB (0.41) ALBALOX15HPGDKMT2ANPC1
SCHEMBL550567 0.71 POLB (0.47) ALBKMT2ARAB9AMEN1ITGB2
SCHEMBL2891984 0.70 NPSR1 (0.39) ALOX15HPGDKMT2AMEN1L3MBTL1
SCHEMBL3377632 0.68 NPSR1 (0.37) ALOX15HPGDL3MBTL1
SCHEMBL28472992 0.68 ALDH1A1 (0.34) ALBHPGDKAT6AKMT2ANPC1
SCHEMBL551671 0.68 PBRM1 (0.42) HPGDKMT2AMEN1HTT
SCHEMBL551442 0.68 FABP4 (0.37) ALOX15HPGDKMT2ARAB9AMEN1

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-1727804-A1 N1 - ((PYRAZOL-1-YMETHYL) -2-METHYLPHENYL)- PHATALAMIDE DERIVATIVES AND RELATED COMPOUNDS INSECTICIDES Bayer CropScience Aktiengesellschaft (DE) 2006-12-06 EP disclosed
WO-2005095351-A1 N1 - ((PYRAZOL-1-YMETHYL) -2-METHYLPHENYL)- PHATALAMIDE DERIVATIVES AND RELATED COMPOUNDS INSECTICIDES BAYER CROPSCIENCE AG (DE) 2005-10-13 WO disclosed