SCHEMBL8993727

SCHEMBL8993727

COc1ccc2cc(S(=O)(=O)NC3CCCN(C(Cc4ccc(C(=N)N)cc4)C(=O)O)C3=O)cc(OC)c2c1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.55
F2 P00734 9/20 0.52
PRSS1 P07477 5/20 0.52
PRSS2 P07478 3/20 0.52
PRSS3 P35030 3/20 0.52
PLG P00747 2/20 0.48
PROC P04070 2/20 0.48
PLAT P00750 1/20 0.48

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
SCHEMBL8993695 0.96 F10 (0.59) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993786 0.93 F10 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993726 0.93 F10 (0.52) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993729 0.91 F2 (0.53) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993746 0.91 F10 (0.66) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993684 0.90 F10 (0.69) F10F2PRSS1PLGPROC
SCHEMBL8993698 0.89 F10 (0.59) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993824 0.89 F10 (0.55) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993778 0.89 F10 (0.56) F10F2PRSS1PRSS2PRSS3
SCHEMBL8993777 0.87 F10 (0.51) F10F2PRSS1PRSS2PRSS3

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
US-5489583-A FOR TREATING OR PREVENTING THROMBOSIS BASF AKTIENGESELLSCHAFT (DE) 1996-02-06 US disclosed