SCHEMBL7314190

SCHEMBL7314190

C=CCN(CC(=O)O)C(=O)C(C)=Cc1ccc(C(=O)Oc2ccc(C(=N)N)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 18/20 1.00
F2 P00734 4/20 1.00
KLK1 P06870 4/20 1.00
TMPRSS15 P98073 15/20 0.54

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
SCHEMBL3238554 1.00 PRSS1 (1.00) PRSS1F2KLK1TMPRSS15
SCHEMBL5569896 0.95 PRSS1 (1.00) PRSS1F2KLK1TMPRSS15
SCHEMBL7309075 0.95 PRSS1 (1.00) PRSS1F2KLK1TMPRSS15
SCHEMBL5574445 0.95 PRSS1 (1.00) PRSS1F2KLK1TMPRSS15
SCHEMBL7189652 0.92 PRSS1 (0.88) PRSS1F2KLK1TMPRSS15
SCHEMBL7189654 0.92 PRSS1 (0.88) PRSS1F2KLK1TMPRSS15
SCHEMBL7191629 0.92 PRSS1 (0.85) PRSS1F2KLK1TMPRSS15
SCHEMBL7191624 0.92 PRSS1 (0.85) PRSS1F2KLK1TMPRSS15
SCHEMBL3239747 0.90 PRSS1 (0.82) PRSS1F2KLK1TMPRSS15
SCHEMBL13459736 0.90 PRSS1 (0.82) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588655-B1 Amidinophenol derivatives ONO PHARMACEUTICAL CO (JP) 1996-12-04 EP claimed
EP-0588655-A1 Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-03-23 EP claimed