SCHEMBL8544141

SCHEMBL8544141

CC(C)C[C@@H](CN1CCC[C@H]1C(=O)O)NS(=O)(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLAU P00749 13/20 0.42
PLG P00747 12/20 0.42
F10 P00742 6/20 0.42
PLAT P00750 1/20 0.40
EPHX2 P34913 1/20 0.39
ADAM17 P78536 1/20 0.39
F2 P00734 1/20 0.37
ST14 Q9Y5Y6 1/20 0.37

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
SCHEMBL8547835 0.83 FKBP1A (0.47) PLAUPLGF10PLATF2
SCHEMBL8541691 0.79 POLB (0.52)
SCHEMBL8541688 0.79 POLB (0.52)
SCHEMBL8542714 0.79 RAB9A (0.39) F2
SCHEMBL8542717 0.79 RAB9A (0.39) F2
SCHEMBL8542711 0.79 RAB9A (0.39) F2
SCHEMBL8548046 0.75 RAB9A (0.36) F2
SCHEMBL8548038 0.75 RAB9A (0.36) F2
SCHEMBL5961946 0.73 EPHX2 (0.51) EPHX2
SCHEMBL8546861 0.72 HTT (0.46) ADAM17

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-0610744-B1 Sulfonamide aminomethylene derivatives as immunosuppressants BAYER AG (US) 1998-11-04 EP claimed