SCHEMBL14570907

SCHEMBL14570907

COCCNc1c(S(C)(=O)=O)ccc(C(=O)c2cnn(C)c2O)c1CSC

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 3/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 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
SCHEMBL14570909 0.89 ALDH1A1 (0.32) ALDH1A1
SCHEMBL14570908 0.89 SYK (0.35) SYK
SCHEMBL14570904 0.86 FGFR4 (0.33) ALDH1A1KDM4E
SCHEMBL5549072 0.84 NR3C1 (0.32) ALDH1A1
SCHEMBL14570902 0.80 NR3C1 (0.32) SYKALDH1A1
SCHEMBL5549100 0.80 MAPK1 (0.36) ALDH1A1KDM4E
SCHEMBL14570910 0.78 SYK (0.32) SYKALDH1A1
SCHEMBL14570905 0.78 ITGA4 (0.33) ALDH1A1KDM4E
SCHEMBL12602573 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL12602575 0.76 ALDH1A1 (0.33) ALDH1A1KDM4E

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
US-7189679-B2 Herbicidal 3-amino-2-thiomethylbenzoylpyrazoles BAYER CROPSCIENCE GMBH (DE) 2007-03-13 US disclosed
US-7189679-B2 Herbicidal 3-amino-2-thiomethylbenzoylpyrazoles BAYER CROPSCIENCE GMBH (DE) 2007-03-13 US disclosed