SCHEMBL8477571

SCHEMBL8477571

CCC(O)Oc1cc(C)cc(OS(=O)(=O)c2ccccc2OC(F)(F)F)c1

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F2 P00734 20/20 0.56
CTRC Q99895 4/20 0.56
PRSS2 P07478 3/20 0.38
F10 P00742 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
SCHEMBL8479188 0.87 F2 (0.56) F2CTRCPRSS2F10
SCHEMBL8478438 0.85 F2 (0.55) F2CTRCPRSS2F10
SCHEMBL8481378 0.83 F2 (0.56) F2CTRCPRSS2
SCHEMBL5674379 0.82 F2 (0.58) F2CTRCPRSS2F10
SCHEMBL8477586 0.82 F2 (0.55) F2CTRCPRSS2
SCHEMBL8477294 0.81 F2 (0.57) F2CTRCPRSS2F10
SCHEMBL5675937 0.80 F2 (0.67) F2CTRCPRSS2
SCHEMBL8481393 0.79 F2 (0.55) F2CTRCPRSS2F10
SCHEMBL8481189 0.78 F2 (0.57) F2CTRCPRSS2F10
SCHEMBL8479211 0.78 F2 (0.54) F2CTRCPRSS2F10

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