SCHEMBL8425322

SCHEMBL8425322

COc1ccc2ccc(S(=O)(=O)CN[C@H]3CCN(Cc4cc(C(=N)N)cs4)C3=O)cc2c1

nearest known ligand 0.80

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 20/20 0.80
F2 P00734 8/20 0.80
KLK6 Q92876 1/20 0.61
PLG P00747 2/20 0.59
PROC P04070 2/20 0.59
PRSS1 P07477 2/20 0.59
PLAT P00750 1/20 0.58

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
SCHEMBL8425318 1.00 F10 (0.80) F10F2KLK6PLGPROC
Trifluoroacetic Acid SCHEMBL8428379 0.94 F10 (0.72) F10F2KLK6PLGPROC
Trifluoroacetic Acid SCHEMBL8425502 0.82 F10 (0.71) F10F2KLK6PLGPROC
SCHEMBL8425320 0.82 KLK6 (0.78) F10F2KLK6PLGPROC
Hydrochloric Acid SCHEMBL7423366 0.81 KLK6 (0.76) F10F2KLK6PLGPROC
Trifluoroacetic Acid SCHEMBL8425346 0.81 F10 (0.72) F10F2KLK6PLGPROC
Trifluoroacetic Acid SCHEMBL2328852 0.80 F10 (0.72) F10F2KLK6PLGPROC
Trifluoroacetic Acid SCHEMBL8425642 0.78 F10 (0.72) F10F2KLK6PLGPROC
Trifluoroacetic Acid SCHEMBL2332758 0.78 KLK6 (0.70) F10F2KLK6PLGPROC
Trifluoroacetic Acid SCHEMBL2332752 0.78 KLK6 (0.70) F10F2KLK6PLGPROC

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-5958918-A Substituted (sulfinic acid, sulfonic acid, sulfonylamino or sulfinylamino) N- (aminominomethyl)phenylalkyl!-azaheterocyclylamide compounds RHONE-POULENC RORER PHARMACEUTICALS INC. 1999-09-28 US disclosed