SCHEMBL4828294

SCHEMBL4828294

O=C(O)C[C@H](NS(=O)(=O)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.59
SENP8 Q96LD8 1/20 0.59
SENP7 Q9BQF6 1/20 0.59
SENP6 Q9GZR1 1/20 0.59
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
MAPT P10636 2/20 0.55
POLB P06746 1/20 0.55
BLM P54132 1/20 0.55
ALDH1A1 P00352 2/20 0.52
GAA P10253 1/20 0.51
SIRT2 Q8IXJ6 1/20 0.51
GPR17 Q13304 3/20 0.51
THRA P10827 1/20 0.50
EEF2K O00418 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
SCHEMBL4824760 0.92 KMT2A (0.61) CASP3SENP8SENP7SENP6MEN1
SCHEMBL4828247 0.84 ITGB3 (0.49) MEN1KMT2A
SCHEMBL30926934 0.81 CASP3 (0.78) CASP3SENP8SENP7SENP6MEN1
SCHEMBL27179883 0.81 CASP3 (0.78) CASP3SENP8SENP7SENP6MEN1
SCHEMBL13532183 0.77 CASP3 (0.85) CASP3SENP8SENP7SENP6MEN1
SCHEMBL30927031 0.77 CASP3 (0.89) CASP3SENP8SENP7SENP6MEN1
SCHEMBL27179429 0.77 CASP3 (0.89) CASP3SENP8SENP7SENP6MEN1
SCHEMBL4828175 0.76 MMP9 (0.59) MEN1KMT2A
SCHEMBL7669603 0.76 MMP9 (0.76) MEN1KMT2A
SCHEMBL7669251 0.76 MMP9 (0.76) MEN1KMT2A

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 CASP3 463/4885SENP8 1191/4885SENP7 610/4885

“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.