Sugi Predict

Sugi Predict / Compounds / SCHEMBL7174609

SCHEMBL7174609

SCHEMBL7174609

CCNS(=O)(=O)c1c(S(=O)(=O)Oc2cc(C)cc(OCCCON(C(=N)NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)c2)ccc2c1OCO2

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 8/20 0.33
▸ CTRC Q99895 1/20 0.32

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
SCHEMBL6749281 0.80 F2 (0.36) F2CTRC
Hydrochloric Acid SCHEMBL6753368 0.80 F2 (0.42) F2CTRC
SCHEMBL6749389 0.77 F2 (0.43) F2CTRC
SCHEMBL6749182 0.76 F2 (0.54) F2CTRC
SCHEMBL6750493 0.75 F2 (0.51) F2CTRC
SCHEMBL6752905 0.74 F2 (0.41) F2CTRC
SCHEMBL6747439 0.74 F2 (0.41) F2CTRC
SCHEMBL6745901 0.74 F2 (0.41) F2CTRC
Hydrochloric Acid SCHEMBL7934197 0.73 F2 (0.41) F2CTRC
SCHEMBL6749687 0.73 CA12 (0.32) —

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-6638931-B1 Aminoguanidines and alkoxyguanidines as protease inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2003-10-28 — — US disclosed