SCHEMBL7051776

SCHEMBL7051776

CCOC(=O)C(CCCc1ccccc1)CP(=O)(COS(=O)(=O)c1ccc(C)cc1)OCC

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 2/20 0.40
MMP2 P08253 4/20 0.37
MMP1 P03956 3/20 0.37
MMP3 P08254 3/20 0.37
MMP9 P14780 3/20 0.37
MMP8 P22894 3/20 0.37
LMNA P02545 1/20 0.37
CNR2 P34972 1/20 0.36
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.36
FDFT1 P37268 1/20 0.35

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
SCHEMBL7052394 0.94 ALDH1A1 (0.39) FKBP1AMMP1LMNAPOLBALDH1A1
SCHEMBL7050902 0.89 PPARG (0.42) MMP9MMP8LMNAPOLB
SCHEMBL7050149 0.87 HSD17B10 (0.37) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7050321 0.86 CA2 (0.39) LMNAPOLBALDH1A1
SCHEMBL7052659 0.81 HSD17B10 (0.41) LMNAALDH1A1
SCHEMBL7053987 0.81 SMN1; SMN2 (0.40) MMP3MMP8LMNAPOLBALDH1A1
SCHEMBL7048895 0.81 MMP2 (0.41) MMP2POLB
SCHEMBL7048015 0.77 ALDH1A1 (0.38) LMNAPOLBALDH1A1
SCHEMBL7047032 0.76 HSD17B10 (0.38) MMP8POLB
SCHEMBL7050928 0.75 EPHX2 (0.46) MMP8LMNAPOLBALDH1A1

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 FKBP1A 396/4885MMP2 8/4885MMP1 2/4885

“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.