SCHEMBL4830132

SCHEMBL4830132

O=C(O)CC[C@H](NS(=O)(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 5/20 0.66
MMP13 P45452 4/20 0.56
MMP8 P22894 2/20 0.56
ADAMTS4 O75173 1/20 0.56
MMP2 P08253 5/20 0.55
ATM Q13315 1/20 0.53
MITF O75030 2/20 0.52
POLB P06746 2/20 0.52
MEN1 O00255 1/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
KMT2A Q03164 1/20 0.52
MMP12 P39900 1/20 0.51
MMP14 P50281 1/20 0.51
CA12 O43570 1/20 0.51
CA9 Q16790 1/20 0.51
GAA P10253 1/20 0.50
MMP3 P08254 3/20 0.49
MAPT P10636 2/20 0.49
LMNA P02545 1/20 0.49

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
SCHEMBL7100832 0.89 MMP9 (0.69) MMP9MMP13MMP8ADAMTS4MMP2
SCHEMBL7669560 0.87 MMP9 (0.72) MMP9MMP13MMP8ADAMTS4MMP2
SCHEMBL4834471 0.87 MMP9 (0.72) MMP9MMP13MMP8ADAMTS4MMP2
SCHEMBL4830195 0.86 MMP2 (0.65) MMP9MMP13MMP8ADAMTS4MMP2
SCHEMBL7674423 0.84 MMP9 (0.57) MMP9MMP13MMP8ADAMTS4MMP2
SCHEMBL14602281 0.81 MMP2 (0.79) MMP9MMP13MMP8ADAMTS4MMP2
SCHEMBL27175577 0.79 MMP2 (0.70) MMP9MMP13MMP8ADAMTS4MMP2
SCHEMBL4832452 0.78 MMP9 (0.61) MMP9ATMMITFPOLBMEN1
SCHEMBL4832393 0.78 MMP9 (0.68) MMP9MMP2ATMMITFPOLB
SCHEMBL8776950 0.78 CA2 (0.64) NPC1RAB9ACA12CA9MAPT

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 9 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 claimed
EP-0757037-A2 Sulfonylamino acid derivatives as metalloproteinase inhibitors ONO PHARMACEUTICAL CO., LTD. (JP) 1997-02-05 EP claimed
US-7335686-B2 Method and composition for treating osteoporosis COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2008-02-26 US disclosed
EP-1678124-A1 NOVEL MOLECULES TO DEVELOP DRUG FOR THE TREATMENT OF OSTEOPOROSIS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2006-07-12 EP disclosed
WO-2005037774-A1 NOVEL MOLECULES TO DEVELOP DRUG FOR THE TREATMENT OF OSTEOPOROSIS COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2005-04-28 WO disclosed
US-20050085537-A1 Method and composition for treating osteoporosis COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2005-04-21 US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050085537-A1 Method and composition for treating osteoporosis SOST, CALCR, MSR1 MMP9 2131/4885MMP13 661/4885MMP8 1030/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.