SCHEMBL2328974

SCHEMBL2328974

COc1ccc2ccc(S(=O)(=O)N(CCC(N)=O)[C@H]3CCN(Cc4cccc(C#N)c4)C3=O)cc2c1

nearest known ligand 0.79

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.79
F2 P00734 12/20 0.79
KLK6 Q92876 3/20 0.58
PLG P00747 2/20 0.54
PROC P04070 2/20 0.54
PLAT P00750 1/20 0.54
PRSS1 P07477 1/20 0.52

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
SCHEMBL2327057 0.94 F10 (0.69) F10F2KLK6PLGPROC
SCHEMBL2332785 0.90 F10 (0.65) F10F2KLK6PLGPROC
SCHEMBL2328912 0.89 F10 (0.73) F10F2KLK6PLGPROC
SCHEMBL2329560 0.88 F10 (0.67) F10F2KLK6PLGPROC
SCHEMBL2332844 0.88 F10 (0.69) F10F2KLK6PLGPROC
SCHEMBL2328762 0.88 F10 (0.67) F10F2KLK6PLGPROC
SCHEMBL2329476 0.86 F10 (0.66) F10F2KLK6PLGPROC
SCHEMBL2329161 0.86 F10 (0.65) F10F2KLK6PLGPROC
SCHEMBL2329857 0.86 F10 (0.68) F10F2KLK6PLGPROC
SCHEMBL2328149 0.86 F10 (0.64) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0853618-B1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL -AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMA INC (US) 2011-08-17 EP disclosed
WO-1996040679-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N-[(AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-12-19 WO disclosed