SCHEMBL7299191

SCHEMBL7299191

O=C(O)[C@@H](Cc1c[nH]c2ccccc12)NS(=O)(=O)c1cccc2ccccc12

nearest known ligand 0.76

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.70
MMP9 P14780 12/20 0.69
MMP2 P08253 10/20 0.69
KMT2A Q03164 3/20 0.66
MEN1 O00255 2/20 0.60
POLB P06746 1/20 0.60
KCNA5 P22460 1/20 0.59
MMP7 P09237 1/20 0.57

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
SCHEMBL20335103 1.00 SMN1; SMN2 (0.70) SMN1; SMN2MMP9MMP2KMT2AMEN1
SCHEMBL20335105 1.00 SMN1; SMN2 (0.70) SMN1; SMN2MMP9MMP2KMT2AMEN1
SCHEMBL29776944 1.00 SMN1; SMN2 (0.70) SMN1; SMN2MMP9MMP2KMT2AMEN1
SCHEMBL8579007 0.87 MMP9 (0.72) SMN1; SMN2MMP9MMP2KMT2AMEN1
SCHEMBL11949521 0.86 NR3C1 (0.72) SMN1; SMN2MMP9MMP2KMT2AMEN1
SCHEMBL5863653 0.86 SMN1; SMN2 (0.64) SMN1; SMN2MMP9MMP2KMT2AKCNA5
SCHEMBL4133797 0.86 SMN1; SMN2 (0.64) SMN1; SMN2MMP9MMP2KMT2AKCNA5
SCHEMBL5191094 0.85 MMP9 (0.89) MMP9MMP2KMT2AMEN1POLB
SCHEMBL6720186 0.85 MMP9 (0.89) MMP9MMP2KMT2AMEN1POLB
SCHEMBL5863661 0.85 MMP9 (0.67) SMN1; SMN2MMP9MMP2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763436-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1998-06-09 US disclosed
US-5595999-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1997-01-21 US disclosed
US-5583133-A ANTICOAGULANTS HOFFMANN-LA ROCHE INC. (US) 1996-12-10 US disclosed
US-5532232-A INHIBIT THROMBIN INDUCED PLATELET AGGREGATION; FIBRINOGEN ANTICOAGULANTS IN BLOOD HOFFMANN-LA ROCHE INC. (US) 1996-07-02 US disclosed
US-5393760-A Cardiovascular disorders, antitumor agents HOFFMANN-LA ROCHE INC. (US) 1995-02-28 US disclosed
EP-0468231-B1 Guanidins HOFFMANN LA ROCHE (CH) 1994-09-21 EP disclosed
US-5260307-A Inhibit thrombin-induced platlet aggregation and clotting of fibrogen in plasma HOFMANN-LA ROCHE INC. (US) 1993-11-09 US disclosed
EP-0468231-A2 Guanidins F. HOFFMANN-LA ROCHE AG (CH) 1992-01-29 EP disclosed