SCHEMBL10525614

SCHEMBL10525614

COC(=O)c1c(S(C)(=O)=O)ccc(C(=O)C2C(=O)CCCC2=O)c1C

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HPD P32754 1/20 0.33

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
SCHEMBL9658540 0.87 SLC6A3 (0.35) VCAM1HPD
SCHEMBL5639574 0.81 HPD (0.36) HPD
SCHEMBL9657374 0.81 HPD (0.36) HPD
SCHEMBL8587711 0.78 HPD (0.34) HPD
SCHEMBL8489212 0.77 VCAM1 (0.40) VCAM1KDM4EHSD17B10
SCHEMBL677614 0.77 HPD (0.36) HPD
SCHEMBL8489410 0.76 VCAM1 (0.40) VCAM1KDM4EHSD17B10
SCHEMBL9134805 0.74 HPD (0.37) HPD
SCHEMBL9651869 0.74 ALDH1A1 (0.36) KDM4EHSD17B10
SCHEMBL6552467 0.73 LMNA (0.47)

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
JP-1143851-A None JP disclosed
JP-H01143851-A SUBSTITUTED BENZOYL DERIVATIVE AND SELECTIVE HERBICIDE NISSAN CHEM IND LTD 1989-06-06 JP disclosed