SCHEMBL7804860

SCHEMBL7804860

CC(C)CC/C=C/S(=O)(=O)O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CA1 P00915 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
SCHEMBL7804861 1.00 CA1 (0.30) CA1
SCHEMBL18091440 0.77 NFKB1 (0.30)
SCHEMBL18091438 0.77 NFKB1 (0.30)
SCHEMBL706499 0.76 CA1 (0.32) CA1
SCHEMBL2723356 0.73
SCHEMBL14704011 0.73
SCHEMBL2723358 0.73
SCHEMBL17360994 0.71 ALDH1A1 (0.33)
SCHEMBL29030447 0.71 ALDH1A1 (0.33)
SCHEMBL2840987 0.71 LMNA (0.35) CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0906333-B1 SUBSTRATES AND INHIBITORS OF PROTEOLYTIC ENZYMES MEDIVIR UK LTD (GB) 2001-07-25 EP disclosed