SCHEMBL8360324

SCHEMBL8360324

CC(C)Nc1ncc(-c2cc(N)cc(OC(=O)C3CC3)c2)n(CC(=O)NCc2ccc(/C(N)=N/C(=O)OCc3ccccc3)cc2)c1=O

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
F7 P08709 19/20 0.58
F3 P13726 7/20 0.43
F2 P00734 5/20 0.42
PRSS1 P07477 2/20 0.42

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
SCHEMBL8360315 0.92 F7 (0.61) F7F3F2PRSS1
SCHEMBL8363692 0.92 F7 (0.61) F7F3F2PRSS1
SCHEMBL8360332 0.92 F7 (0.61) F7F3F2PRSS1
SCHEMBL8360323 0.90 F7 (0.59) F7F3F2PRSS1
SCHEMBL8363218 0.90 F7 (0.59) F7F3F2PRSS1
SCHEMBL8362470 0.90 F7 (0.59) F7F3F2PRSS1
SCHEMBL8363673 0.89 F7 (0.65) F7F3F2PRSS1
SCHEMBL8363431 0.88 F7 (0.72) F7F3F2PRSS1
SCHEMBL8363182 0.88 F7 (0.66) F7F3F2PRSS1
SCHEMBL8360104 0.87 F7 (0.66) F7F3F2PRSS1

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