SCHEMBL7420914

SCHEMBL7420914

COc1ccc2ccc(S(=O)(=O)N(C)[C@H]3CCN(Cc4ccsc4)C3=O)cc2c1.NC=NO

nearest known ligand 0.67

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.67
F2 P00734 12/20 0.67
PLG P00747 1/20 0.67
PLAT P00750 1/20 0.67
PROC P04070 1/20 0.67
KLK6 Q92876 3/20 0.64

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
Trifluoroacetic Acid SCHEMBL2324840 0.94 F10 (0.60) F10F2PLGPLATPROC
SCHEMBL2330458 0.79 F10 (0.74) F10F2PLGPLATPROC
SCHEMBL7550978 0.77 F10 (0.68) F10F2PLGPLATPROC
SCHEMBL2332489 0.77 F10 (0.97) F10F2PLGPLATPROC
SCHEMBL2330097 0.77 KLK6 (0.76) F10F2PLGPLATPROC
SCHEMBL8425320 0.77 KLK6 (0.78) F10F2PLGPLATPROC
SCHEMBL7213544 0.77 F10 (0.67) F10F2PLGPLATPROC
Hydrochloric Acid SCHEMBL7423366 0.76 KLK6 (0.76) F10F2PLGPLATPROC
SCHEMBL2333265 0.76 F10 (0.77) F10F2PLGPLATPROC
SCHEMBL8423783 0.76 F10 (0.72) F10F2PLGPLATPROC

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0853618-A4 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE POULENC RORER PHARMA (US) 2000-03-15 EP disclosed
EP-0853618-A1 SUBSTITUTED (SULFINIC ACID, SULFONIC ACID, SULFONYLAMINO OR SULFINYLAMINO) N- (AMINOIMINOMETHYL)PHENYLALKYL]-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-07-22 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