SCHEMBL7671736

SCHEMBL7671736

O=C(Nc1ccc(S(=O)(=O)N[C@H](Cc2cnc[nH]2)C(=O)OCc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 9/20 0.57
MMP2 P08253 4/20 0.57
LTA4H P09960 1/20 0.51
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
MME P08473 1/20 0.46
ECE1 P42892 1/20 0.46
CTSL P07711 1/20 0.46
S1PR1 P21453 3/20 0.45

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
SCHEMBL7671594 0.88 MMP2 (0.68) MMP9MMP2CA1CA2
SCHEMBL7671733 0.82 MMP9 (0.57) MMP9MMP2CTSL
SCHEMBL7665147 0.82 MMP9 (0.71) MMP9MMP2CTSL
SCHEMBL7663396 0.82 MMP9 (0.71) MMP9MMP2CTSL
SCHEMBL7673655 0.80 MMP9 (0.78) MMP9MMP2
SCHEMBL7667544 0.80 MMP9 (0.78) MMP9MMP2
SCHEMBL9554556 0.75 MME (0.52) LTA4HMMEECE1S1PR1
SCHEMBL7583642 0.75 MMP9 (0.70) MMP9MMP2
SCHEMBL28366545 0.74 MME (0.61) MMEECE1
SCHEMBL14191412 0.74 MMP9 (0.74) MMP9MMP2CA1CA2CTSL

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