SCHEMBL8363363

SCHEMBL8363363

COc1cccc(COC(=O)/N=C(\N)c2ccc(CNC(=O)Cn3c(-c4cc(N)cc(C(=O)O)c4)cnc(NC(C)C)c3=O)cc2)c1

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F7 P08709 20/20 0.67
F3 P13726 9/20 0.51
PRSS1 P07477 1/20 0.51
F2 P00734 5/20 0.46

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
SCHEMBL8363431 0.94 F7 (0.72) F7F3PRSS1F2
SCHEMBL8360779 0.90 F7 (0.65) F7F3PRSS1F2
SCHEMBL6794121 0.90 F7 (0.71) F7F3PRSS1F2
SCHEMBL6794111 0.90 F7 (0.71) F7F3PRSS1F2
SCHEMBL8363182 0.90 F7 (0.66) F7F3PRSS1F2
SCHEMBL6792574 0.89 F7 (0.68) F7F3PRSS1F2
SCHEMBL6792580 0.89 F7 (0.68) F7F3PRSS1F2
SCHEMBL6794170 0.89 F7 (0.73) F7F3PRSS1F2
SCHEMBL6794162 0.89 F7 (0.73) F7F3PRSS1F2
SCHEMBL8360104 0.89 F7 (0.66) F7F3PRSS1F2

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
WO-2003028729-A2 PRODRUGS OF SUBSTITUTED POLYCYCLIC COMPOUNDS USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2003-04-10 WO disclosed