SCHEMBL7052863

SCHEMBL7052863

CCOC(=O)C(Cc1ccccc1)C(CSc1ccccc1OCC)[PH2]=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP8 P22894 1/20 0.39
PTGS2 P35354 1/20 0.37
L3MBTL1 Q9Y468 3/20 0.36
GLA P06280 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
PKM P14618 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HIF1A Q16665 1/20 0.34
TSHR P16473 1/20 0.34
EPHX2 P34913 1/20 0.34
PPARG P37231 1/20 0.34
GAA P10253 1/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 1/20 0.34
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
NPY1R P25929 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
SCHEMBL7049843 0.89 SMN1; SMN2 (0.41) PTGS2L3MBTL1GLAMRGPRX4LMNA
SCHEMBL7047039 0.88 KMT2A (0.39) PTGS2L3MBTL1GLAPOLBPPARG
SCHEMBL7049697 0.86 L3MBTL1 (0.35) PTGS2L3MBTL1GLACYP1A2CYP2C9
SCHEMBL7051259 0.84 AVPR1A (0.37) MMP8PTGS2LMNAPOLBTSHR
SCHEMBL7049614 0.81 MEN1 (0.38) L3MBTL1TSHRGAARAB9AALDH1A1
SCHEMBL9067053 0.76 PRNP (0.53) MMP8L3MBTL1LMNACYP1A2CYP2C9
SCHEMBL7052111 0.74 NPSR1 (0.38) LMNAPOLBTSHRRAB9AALDH1A1
SCHEMBL7052126 0.73 KMT2A (0.36) LMNAPOLBTSHREPHX2PPARG
SCHEMBL892960 0.72 MMP8 (0.61) MMP8L3MBTL1LMNAPOLBPKM
SCHEMBL7050272 0.72 SLC1A3 (0.43) PKMCYP1A2TSHRPPARG

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 MMP8 21/4885PTGS2 358/4885L3MBTL1 2428/4885

“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.