SCHEMBL8927572

SCHEMBL8927572

CC(NS(=O)(=O)c1ccc2ccccc2c1)C(=O)C1([N]C(=O)NCC2CCN(C(=N)N)CC2)CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
F2 P00734 20/20 0.55
F10 P00742 1/20 0.47
PLG P00747 1/20 0.47
PLAU P00749 1/20 0.47
ST14 Q9Y5Y6 1/20 0.47

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
SCHEMBL8926144 0.96 F2 (0.53) F2F10PLGPLAUST14
SCHEMBL8717253 0.80 F2 (0.54) F2
SCHEMBL8716830 0.79 F2 (0.51) F2F10PLGPLAUST14
SCHEMBL8721722 0.78 F2 (0.55) F2
Hydrochloric Acid SCHEMBL8716813 0.76 F2 (0.52) F2
Hydrochloric Acid SCHEMBL8927476 0.75 F2 (0.54) F2
SCHEMBL8717274 0.75 F2 (0.72) F2
SCHEMBL8926952 0.74 PLG (0.39) F2F10PLGPLAU
SCHEMBL8720076 0.73 F2 (0.67) F2
Hydrochloric Acid SCHEMBL8720100 0.73 F2 (0.53) F2F10PLGPLAUST14

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-5677448-A CHEMICAL INTERMEDIATES FOR MAKING ANTAGONIST OF THROMBIN, TREATING THROMBOSIS, STROKE, INFLAMMATION, ARTERIOSCLEROSIS, CARDIOVASCULAR DISORDERS HOFFMANN-LA ROCHE INC. (US) 1997-10-14 US disclosed