SCHEMBL7302320

SCHEMBL7302320

Cc1ccc2[nH]cc(CC(NS(=O)(=O)c3ccc4ccccc4c3)C(=O)O)c2c1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.67
ADAM17 P78536 6/20 0.67
MMP13 P45452 2/20 0.67
MMP14 P50281 2/20 0.67
MMP9 P14780 10/20 0.64
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
POLB P06746 1/20 0.58
KCNA5 P22460 1/20 0.58
MMP7 P09237 1/20 0.56

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
SCHEMBL7302324 1.00 MMP2 (0.67) MMP2ADAM17MMP13MMP14MMP9
SCHEMBL7290422 0.89 MMP9 (0.77) MMP2ADAM17MMP9MEN1KMT2A
SCHEMBL7290418 0.89 MMP9 (0.77) MMP2ADAM17MMP9MEN1KMT2A
SCHEMBL7300467 0.86 MMP9 (0.75) MMP2ADAM17MMP9MEN1KMT2A
SCHEMBL8428419 0.84 ADAM17 (0.79) MMP2ADAM17MMP13MMP14MMP9
SCHEMBL3154749 0.83 MMP9 (0.88) MMP2ADAM17MMP9MEN1KMT2A
SCHEMBL3154764 0.83 MMP9 (0.88) MMP2ADAM17MMP9MEN1KMT2A
SCHEMBL7291364 0.82 MMP9 (0.72) MMP2ADAM17MMP9MEN1KMT2A
SCHEMBL23752240 0.80 ADAM17 (1.00) MMP2ADAM17MMP13MMP14MMP9
SCHEMBL3848822 0.80 ADAM17 (1.00) MMP2ADAM17MMP13MMP14MMP9

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