SCHEMBL8926247

SCHEMBL8926247

CS(=O)(=O)NC(C(=O)NC1CC1)C(CC1CCCN(C(=N)N)C1)C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.37
CPB2 Q96IY4 1/20 0.37
F10 P00742 4/20 0.36
PLG P00747 3/20 0.36
PRSS1 P07477 3/20 0.36
F2 P00734 16/20 0.36
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP8 P22894 1/20 0.34
MMP13 P45452 1/20 0.34
TPSAB1 Q15661 1/20 0.34
TPSD1 Q9BZJ3 1/20 0.34
TPSG1 Q9NRR2 1/20 0.34
PRSS2 P07478 1/20 0.33
CTRC Q99895 1/20 0.33

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
SCHEMBL8927494 0.83 F2 (0.45) F10F2MMP1MMP2MMP3
SCHEMBL8927498 0.83 F2 (0.42) F10PLGF2
SCHEMBL8927392 0.80 F2 (0.42) F2
SCHEMBL8719867 0.77 F2 (0.51) F2
SCHEMBL8926218 0.68 F2 (0.42) F10PLGF2
SCHEMBL18265351 0.63 EED (0.49) CPN1CPB2F10F2TPSAB1
SCHEMBL15373361 0.62 EED (0.46) CPN1CPB2F2TPSAB1TPSD1
SCHEMBL1542957 0.61 F2 (0.48) CPN1CPB2F2TPSAB1TPSD1
SCHEMBL14633701 0.61 TPSAB1 (0.38) CPN1CPB2F10PRSS1F2
SCHEMBL14599993 0.61 TPSAB1 (0.38) CPN1CPB2F10PRSS1F2

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