SCHEMBL7996791

SCHEMBL7996791

CSc1sc(C(=N)N)cc1Nc1ccc(OCNc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PLAU P00749 14/20 0.53
C1S P09871 6/20 0.46

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
SCHEMBL6920484 0.86 PLAU (0.69) PLAUC1S
Hydrochloric Acid SCHEMBL6920775 0.85 PLAU (0.68) PLAUC1S
SCHEMBL6921142 0.85 PLAU (0.63) PLAUC1S
SCHEMBL13946253 0.85 PLAU (0.61) PLAUC1S
SCHEMBL6927242 0.84 PLAU (0.66) PLAUC1S
Hydrochloric Acid SCHEMBL6924811 0.84 PLAU (0.61) PLAUC1S
SCHEMBL7380452 0.82 PLAU (0.64) PLAUC1S
SCHEMBL7996788 0.81 PLAU (0.50) PLAUC1S
SCHEMBL6924620 0.81 PLAU (0.63) PLAUC1S
SCHEMBL6928673 0.81 PLAU (0.64) PLAUC1S

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-6291514-B1 Heteroaryl amidines, methylamidines and guanidines, preparation thereof, and use thereof as protease inhibitors 3-DIMENSIONAL PHARMACEUTICALS, INC. 2001-09-18 US disclosed