SCHEMBL7051089

SCHEMBL7051089

CCOC(=O)C(CCCc1ccccc1)CP(=O)(CSc1ccc2ccccc2c1)OCC

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT5 Q9NXA8 1/20 0.38
PTGES O14684 2/20 0.37
ALOX5 P09917 2/20 0.37
PPARG P37231 2/20 0.37
EPHX2 P34913 1/20 0.37
ALDH1A1 P00352 1/20 0.36
BCL2 P10415 1/20 0.36
BCL2L1 Q07817 1/20 0.36
MCL1 Q07820 1/20 0.36
BCL2A1 Q16548 1/20 0.36
HDAC1 Q13547 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
GAA P10253 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
MMP2 P08253 1/20 0.34

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
SCHEMBL7049135 0.94 SMN1; SMN2 (0.37) SIRT5PPARGEPHX2ALDH1A1BCL2
SCHEMBL7047032 0.91 HSD17B10 (0.38) PPARGEPHX2HSD17B10MAPTGRIK1
SCHEMBL7049822 0.89 PPARG (0.43) PPARGEPHX2ALDH1A1HSD17B10GAA
SCHEMBL7050333 0.88 PPARG (0.39) ALOX5PPARGEPHX2ALDH1A1MAPT
SCHEMBL7052124 0.85 EPHX2 (0.34) PTGESALOX5PPARGEPHX2ALDH1A1
SCHEMBL7049839 0.85 SMN1; SMN2 (0.40) PPARGEPHX2ALDH1A1HDAC1HSD17B10
SCHEMBL7046328 0.84 PRNP (0.47) ALDH1A1KDM4EMAPTMMP2BMP1
SCHEMBL7050113 0.83 HSD17B10 (0.44) EPHX2ALDH1A1HSD17B10KDM4EMAPT
SCHEMBL7048895 0.81 MMP2 (0.41) ALOX5PPARGEPHX2HSD17B10MAPT
SCHEMBL7052860 0.79 EPHX2 (0.46) PPARGEPHX2ALDH1A1HSD17B10

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 SIRT5 1118/4885PTGES 362/4885ALOX5 1132/4885

“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.