SCHEMBL7673655

SCHEMBL7673655

O=C(Nc1ccc(S(=O)(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)OCc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 13/20 0.78
MMP2 P08253 9/20 0.70
TACR1 P25103 4/20 0.60
KCNA5 P22460 1/20 0.59
HDAC2 Q92769 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58

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
SCHEMBL7667544 1.00 MMP9 (0.78) MMP9MMP2TACR1KCNA5HDAC2
SCHEMBL7583642 0.94 MMP9 (0.70) MMP9MMP2TACR1KCNA5HDAC2
SCHEMBL7665932 0.88 MMP9 (1.00) MMP9MMP2
SCHEMBL7669539 0.88 MMP9 (1.00) MMP9MMP2
SCHEMBL7878205 0.86 MMP2 (0.69) MMP9MMP2TACR1KCNA5
SCHEMBL29883928 0.86 MMP2 (0.69) MMP9MMP2TACR1KCNA5
SCHEMBL7894567 0.86 MMP9 (0.66) MMP9MMP2TACR1KCNA5
SCHEMBL7587014 0.82 MMP9 (0.88) MMP9MMP2
SCHEMBL9262155 0.82 TACR1 (0.71) MMP9MMP2TACR1KCNA5
SCHEMBL5099123 0.82 MMP9 (0.68) MMP9MMP2KCNA5

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
US-6403644-B1 FOR PREVENTION AND/OR TREATMENT OF DISEASES INDUCED BY OVEREXPRESSION AND EXCESS ACTIVITY OF MATRIX METALLOPROTEINASE; FOR EXAMPLE, RHEUMATOID, ARTHROSTEITIS, UNUSUAL BONE RESORPTION, OSTEOPOROSIS, PERIODONTITIS ONO PHARMACEUTICAL CO., LTD. (JP) 2002-06-11 US disclosed
US-6177466-B1 Sulfonylamino acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2001-01-23 US disclosed
EP-0757037-A2 Sulfonylamino acid derivatives as metalloproteinase inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 1997-02-05 EP disclosed