SCHEMBL7052860

SCHEMBL7052860

CCOC(=O)C(Cc1ccccc1)CP(=O)(CSc1ccccc1)OCC

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.46
PPARG P37231 4/20 0.46
MMP8 P22894 1/20 0.42
HSD17B10 Q99714 1/20 0.41
PPARA Q07869 2/20 0.40
HPRT1 P00492 1/20 0.40
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
KMT2A Q03164 1/20 0.40
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.38
ALDH1A1 P00352 3/20 0.38
HPGD P15428 1/20 0.38
POLB P06746 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.36

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
SCHEMBL7049822 0.90 PPARG (0.43) EPHX2PPARGMMP8HSD17B10PPARA
SCHEMBL7049839 0.90 SMN1; SMN2 (0.40) EPHX2PPARGHSD17B10MEN1NPC1
SCHEMBL7052148 0.88 POLB (0.45) EPHX2PPARGHSD17B10MEN1NPC1
SCHEMBL7047032 0.88 HSD17B10 (0.38) EPHX2PPARGMMP8HSD17B10MEN1
SCHEMBL7049694 0.87 HSD17B10 (0.50) MMP8HSD17B10MEN1NPC1KMT2A
SCHEMBL7051256 0.84 PPARG (0.43) EPHX2PPARGMMP8HSD17B10PPARA
SCHEMBL7049872 0.84 EPHX2 (0.51) EPHX2PPARGMMP8HSD17B10PPARA
SCHEMBL7049089 0.83 PRNP (0.52) EPHX2PPARGMMP8MEN1NPC1
SCHEMBL7049610 0.82 ALDH1A1 (0.39) HSD17B10MEN1NPC1KMT2AALDH1A1
SCHEMBL7049135 0.81 SMN1; SMN2 (0.37) EPHX2PPARGHSD17B10PPARAMEN1

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 EPHX2 2309/4885PPARG 3903/4885MMP8 21/4885

“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.