SCHEMBL5573460

SCHEMBL5573460

C/C(=C\c1ccc(C(=O)Oc2ccc(C(=N)N)cc2)cc1)C(=O)N(C1CCCCC1)C(CC(=O)O)CC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 19/20 0.56
F2 P00734 4/20 0.56
KLK1 P06870 4/20 0.56
TMPRSS15 P98073 15/20 0.41

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
SCHEMBL3232998 0.91 PRSS1 (0.58) PRSS1F2KLK1TMPRSS15
SCHEMBL3245126 0.86 PRSS1 (0.66) PRSS1F2KLK1TMPRSS15
SCHEMBL7304838 0.86 PRSS1 (0.66) PRSS1F2KLK1TMPRSS15
SCHEMBL3237141 0.85 PRSS1 (0.67) PRSS1F2KLK1TMPRSS15
SCHEMBL7518605 0.85 PRSS1 (0.59) PRSS1F2KLK1TMPRSS15
SCHEMBL7518598 0.85 PRSS1 (0.59) PRSS1F2KLK1TMPRSS15
SCHEMBL3241353 0.81 PRSS1 (0.69) PRSS1F2KLK1TMPRSS15
SCHEMBL3237729 0.79 PRSS1 (0.69) PRSS1F2KLK1TMPRSS15
SCHEMBL3241766 0.78 PRSS1 (0.70) PRSS1F2KLK1TMPRSS15
SCHEMBL3231286 0.77 PRSS1 (0.80) PRSS1F2KLK1TMPRSS15

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
EP-1815865-A1 THERAPEUTIC AGENT FOR DIABETES COMPRISING PROTEASE-INHIBITING COMPOUND ONO PHARMACEUTICAL CO., LTD. (JP) 2007-08-08 EP disclosed