SCHEMBL7385658

SCHEMBL7385658

COc1ccc2ccc(S(=O)(=O)N[C@@]3(Cc4csc5ccnc(Cl)c45)CCNC3=O)cc2c1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PARG Q86W56 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
F2 P00734 9/20 0.35
F10 P00742 4/20 0.35
RAPGEF3 O95398 1/20 0.35
PRSS1 P07477 4/20 0.35
HPGDS O60760 1/20 0.32
POLB P06746 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PLAU P00749 1/20 0.32

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
SCHEMBL7381947 0.84 MEN1 (0.35) PARGMEN1KMT2AF2F10
SCHEMBL7382013 0.77 F2 (0.36) PARGMEN1KMT2AF2F10
Trifluoroacetic Acid SCHEMBL7385566 0.77 RAPGEF3 (0.35) MEN1KMT2AF2F10RAPGEF3
SCHEMBL7384883 0.74 F10 (0.40) PARGMEN1KMT2AF2F10
SCHEMBL2364436 0.74 F10 (0.38) PARGMEN1KMT2AF2F10
SCHEMBL7544799 0.74 F10 (0.62) F2F10PRSS1
SCHEMBL7382892 0.72 NCF1 (0.43) MEN1KMT2AF2F10RAPGEF3
Trifluoroacetic Acid SCHEMBL7375646 0.71 RAPGEF3 (0.35) MEN1KMT2AF2F10RAPGEF3
SCHEMBL7374683 0.70 F10 (0.37) PARGF2F10RAPGEF3PLAU
Trifluoroacetic Acid SCHEMBL7384671 0.70 NOS1 (0.37) F2F10RAPGEF3PRSS1HPGDS

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-0944386-A4 SULFONIC ACID OR SULFONYLAMINO N-(HETEROARALKYL)-AZAHETEROCYCLYLAMIDE COMPOUNDS AVENTIS PHARM PROD INC (US) 2001-04-11 EP 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