SCHEMBL7048974

SCHEMBL7048974

CC(C)CC(CC(=O)N(NC(=O)c1ccc(C(=O)O)cc1)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.47
MMP12 P39900 2/20 0.47
MMP13 P45452 2/20 0.47
MMP7 P09237 1/20 0.47
MMP9 P14780 1/20 0.47
MME P08473 3/20 0.47
ECE1 P42892 1/20 0.45
MMP1 P03956 2/20 0.42
CTSK P43235 1/20 0.42
FCER2 P06734 1/20 0.42

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
SCHEMBL7048194 0.93 MMP7 (0.46) MMP2MMP12MMP13MMP7MMP9
SCHEMBL7052628 0.86 MMP8 (0.44) MMP7MMEECE1MMP1CTSK
SCHEMBL7047135 0.86 MMP8 (0.49) MMP2MMP12MMP13MMEECE1
SCHEMBL6418968 0.81 CA2 (0.45) MMP2MMP12MMP13MMP7MMP9
SCHEMBL7050945 0.81 CA2 (0.45) MMP2MMP12MMP13MMP7MMP9
SCHEMBL7050174 0.75 MMP7 (0.53) MMP2MMP12MMP13MMP7MMP9
SCHEMBL6417550 0.75 MMP7 (0.53) MMP2MMP12MMP13MMP7MMP9
SCHEMBL7052597 0.74 MME (0.54) MMP2MMP12MMP13MMP7MMP9
SCHEMBL7046360 0.73 MMP8 (0.52) MMP2MMP12MMP13MMP7MME
SCHEMBL7050237 0.71 MMP8 (0.49) MMP2MMP12MMP13MMP7MME

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030212067-A1 Matrix metalloprotease inhibitors CASTELHANO ARLINDO LUCAS (US) 2003-11-13 US disclosed
US-6579890-B1 Matrix metalloprotease inhibitors SYNTEX (U.S.A.) INC. 2003-06-17 US disclosed
US-6037472-A FOR TREATING DISEASE-STATES CHARACTERIZED BY EXCESSIVE ACTIVITY OF MATRIX METALLOPROTEASES SUCH AS RHEUMATOID ARTHRITIS, OSTEOARTHRITIS, PERIODONTAL DISEASE, ABERRANT ANGIOGENESIS, TUMOR INVASION AND METASTASIS SYNTEX (U.S.A.) INC. (US) 2000-03-14 US disclosed
EP-0793643-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1997-09-10 EP disclosed
EP-0726903-B1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX INC (US) 1997-07-16 EP disclosed
WO-1996016027-A1 MATRIX METALLOPROTEASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-05-30 WO 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-20030212067-A1 Matrix metalloprotease inhibitors MMP7, MMP1, MMP3 MMP2 8/4885MMP12 22/4885MMP13 14/4885

“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.