SCHEMBL7374683

SCHEMBL7374683

COc1ccc2ccc(S(=O)(=O)N[C@@]3(Cc4ccc(N)c([N+](=O)[O-])c4)CCNC3=O)cc2c1

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 10/20 0.37
F2 P00734 2/20 0.37
RAPGEF3 O95398 1/20 0.37
PLAU P00749 1/20 0.37
PARG Q86W56 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL7375549 0.92 F10 (0.37) F10F2RAPGEF3PLAUPARG
SCHEMBL7384883 0.90 F10 (0.40) F10F2RAPGEF3PLAUPARG
Trifluoroacetic Acid SCHEMBL7374889 0.78 NOS1 (0.46) F10F2RAPGEF3
SCHEMBL2364436 0.74 F10 (0.38) F10F2RAPGEF3PLAUPARG
SCHEMBL7214277 0.71 F10 (0.69) F10F2
Trifluoroacetic Acid SCHEMBL7384671 0.71 NOS1 (0.37) F10F2RAPGEF3SMN1; SMN2
SCHEMBL7385658 0.70 PARG (0.36) F10F2RAPGEF3PLAUPARG
SCHEMBL7537057 0.70 F10 (0.60) F10F2
SCHEMBL7381947 0.70 MEN1 (0.35) F10F2RAPGEF3PLAUPARG
Trifluoroacetic Acid SCHEMBL7471306 0.69 F2 (0.41) F10F2RAPGEF3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086099-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2002-01-02 EP disclosed
EP-0944386-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2001-04-11 EP disclosed
EP-1086099-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS Aventis Pharmaceuticals Products Inc. (US) 2001-03-28 EP disclosed
WO-1999062904-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-12-09 WO disclosed
EP-0944386-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1999-09-29 EP disclosed
WO-1998025611-A1 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS RHÔNE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-06-18 WO disclosed