SCHEMBL8606705

SCHEMBL8606705

CCOC(=O)CN(CCCOC)C(=O)C(C)=Cc1ccc(C(=O)Oc2ccc(C(=N)N)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 12/20 0.73
F2 P00734 4/20 0.73
KLK1 P06870 4/20 0.73
TMPRSS15 P98073 11/20 0.50
KDM4E B2RXH2 3/20 0.41
MAPT P10636 3/20 0.41
KMT2A Q03164 3/20 0.41
HSP90AA1 P07900 2/20 0.41
LMNA P02545 1/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
ACR P10323 1/20 0.37

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
SCHEMBL8606708 1.00 PRSS1 (0.73) PRSS1F2KLK1TMPRSS15KDM4E
Acetic Acid SCHEMBL8609048 0.98 PRSS1 (0.71) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL8609297 0.95 PRSS1 (0.76) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL7526740 0.95 PRSS1 (0.76) PRSS1F2KLK1TMPRSS15KDM4E
Acetic Acid SCHEMBL8610126 0.93 PRSS1 (0.73) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL7621301 0.92 PRSS1 (0.65) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL7621297 0.92 PRSS1 (0.65) PRSS1F2KLK1TMPRSS15KDM4E
SCHEMBL3241552 0.92 PRSS1 (0.77) PRSS1F2KLK1TMPRSS15KDM4E
Hydrochloric Acid SCHEMBL8610706 0.91 PRSS1 (0.64) PRSS1F2KLK1TMPRSS15KDM4E
Hydrochloric Acid SCHEMBL8610704 0.91 PRSS1 (0.64) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0656349-B1 Amidinophenol derivatives having phospholipase A2 inhibitory activity ONO PHARMACEUTICAL CO (JP) 1998-04-08 EP claimed
EP-0656349-A1 Amidinophenol derivatives having phospholipase A2 inhibitory activity ONO PHARMACEUTICAL CO., LTD. (JP) 1995-06-07 EP claimed