SCHEMBL7306265

SCHEMBL7306265

C/C(=C\c1ccc(C(=O)Oc2ccc(C(=N)N)cc2)cc1)C(=O)N(CC(=O)O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 15/20 0.68
F2 P00734 5/20 0.68
KLK1 P06870 4/20 0.68
TMPRSS15 P98073 11/20 0.51
KDM4E B2RXH2 2/20 0.43
HSP90AA1 P07900 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.41
PARP10 Q53GL7 1/20 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
SCHEMBL7306272 1.00 PRSS1 (0.68) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL3233414 0.91 PRSS1 (0.69) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL7303571 0.91 PRSS1 (0.69) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL3236111 0.85 PRSS1 (0.73) PRSS1F2KLK1TMPRSS15
SCHEMBL7312246 0.84 PRSS1 (0.75) PRSS1F2KLK1TMPRSS15
SCHEMBL7312240 0.84 PRSS1 (0.75) PRSS1F2KLK1TMPRSS15
SCHEMBL3231286 0.84 PRSS1 (0.80) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL3241353 0.83 PRSS1 (0.69) PRSS1F2KLK1TMPRSS15
SCHEMBL3239647 0.83 PRSS1 (0.69) PRSS1F2KLK1TMPRSS15
SCHEMBL7314578 0.82 PRSS1 (0.77) PRSS1F2KLK1TMPRSS15KDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5622984-A INHIBITORS OF PHOSPHOLIPASE, VARIOUS PROTEASES ONO PHARMACEUTICAL COMPANY, LIMITED (JP) 1997-04-22 US disclosed
US-5614555-A Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1997-03-25 US disclosed
EP-0588655-B1 Amidinophenol derivatives ONO PHARMACEUTICAL CO (JP) 1996-12-04 EP disclosed
US-5432178-A Substituted benzoic acid esters; use to prevent or treat inflammatory diseases, allergic diseases, disseminated intravascular coagulation, pancreatitis or multiple organ failure ONO PHARMACEUTICAL CO., LTD. (JP) 1995-07-11 US disclosed
EP-0588655-A1 Amidinophenol derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1994-03-23 EP disclosed