SCHEMBL4968377

SCHEMBL4968377

COc1c(S(C)(=O)=O)ccc(C(=O)c2c(C)n[nH]c2O)c1C

nearest known ligand 0.56

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL4966361 0.86
SCHEMBL7811578 0.83 FPR2 (0.31)
SCHEMBL7808943 0.80 CNR2 (0.32)
SCHEMBL7814563 0.79 CYP1A2 (0.32) PDE4DALDH1A1
SCHEMBL4969997 0.76 POLB (0.32)
SCHEMBL7811746 0.75 FPR2 (0.30)
SCHEMBL15649177 0.74
SCHEMBL1358599 0.73 TDP1 (0.44) ALDH1A1
SCHEMBL7814573 0.72 RORC (0.32)
SCHEMBL8678853 0.72 SMN1; SMN2 (0.35) ALDH1A1

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-1963274-A1 BENZOYLPYRAZOLE COMPOUNDS AND HERBICIDES CONTAINING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 2008-09-03 EP disclosed
WO-2007069771-A1 BENZOYLPYRAZOLE COMPOUNDS AND HERBICIDES CONTAINING THEM ISHIHARA SANGYO KAISHA, LTD. (JP) 2007-06-21 WO disclosed