SCHEMBL7539613

SCHEMBL7539613

CCN1CC(C(=O)OC)C(c2cccc(C(=N)N)c2)C1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.62
PRSS1 P07477 13/20 0.62

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
SCHEMBL6984953 0.87 F10 (0.73) F10PRSS1
SCHEMBL6983480 0.87 F10 (0.73) F10PRSS1
SCHEMBL6984948 0.87 F10 (0.73) F10PRSS1
SCHEMBL6983485 0.87 F10 (0.73) F10PRSS1
SCHEMBL6978146 0.78 F10 (0.76) F10PRSS1
SCHEMBL6983242 0.78 F10 (1.00) F10PRSS1
SCHEMBL6977107 0.78 F10 (1.00) F10PRSS1
SCHEMBL6983948 0.78 F10 (1.00) F10PRSS1
SCHEMBL6978851 0.77 F10 (0.54) F10PRSS1
SCHEMBL6978845 0.77 F10 (0.54) F10PRSS1

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-0934265-A1 AMIDINOPHENYL-PYRROLIDINES, -PYRROLINES, AND -ISOXAZOLIDINES AND DERIVATIVES THEREOF Du Pont Pharmaceuticals Company (US) 1999-08-11 EP disclosed
WO-1998006694-A1 AMIDINOPHENYL-PYRROLIDINES, -PYRROLINES, AND -ISOXAZOLIDINES AND DERIVATIVES THEREOF DU PONT PHARMACEUTICALS COMPANY (US) 1998-02-19 WO disclosed