SCHEMBL8480467

SCHEMBL8480467

Cc1cc(OC(C)C=O)cc(OS(=O)(=O)c2cccc(Cl)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 6/20 0.48
HTR6 P50406 1/20 0.39
PGR P06401 3/20 0.39
TDP1 Q9NUW8 1/20 0.38

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
SCHEMBL8482953 0.89 F2 (0.50) F2HTR6TDP1
SCHEMBL8480761 0.85 F2 (0.41) F2HTR6PGR
SCHEMBL8479279 0.85 F2 (0.41) F2PGR
SCHEMBL8484049 0.82 P2RY2 (0.41) F2PGR
SCHEMBL8482307 0.82 F2 (0.48) F2
SCHEMBL8482824 0.81 F2 (0.52) F2TDP1
SCHEMBL8481772 0.81 F2 (0.54) F2HTR6
SCHEMBL8480305 0.81 F2 (0.53) F2
SCHEMBL8476682 0.80 F2 (0.56) F2
SCHEMBL8476604 0.79 F2 (0.51) F2HTR6PGRTDP1

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
US-5891909-A Amidinohydrazones as protease inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. (US) 1999-04-06 US disclosed