SCHEMBL7048898

SCHEMBL7048898

CCOC(=O)C(CCCc1ccccc1)(C[PH](=O)CO)OCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MMP8 P22894 1/20 0.38
ALOX5 P09917 1/20 0.38
TAAR1 Q96RJ0 2/20 0.38
LMNA P02545 2/20 0.38
THRB P10828 1/20 0.38
PIN1 Q13526 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MAPT P10636 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 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
SCHEMBL7049813 0.93 ALDH1A1 (0.40) RECQLALDH1A1MMP8ALOX5TAAR1
SCHEMBL7047044 0.86 ALDH1A1 (0.35) RECQLALDH1A1MMP8ALOX5TAAR1
SCHEMBL7049880 0.85 ALDH1A1 (0.47) RECQLALDH1A1MMP8TAAR1LMNA
SCHEMBL7050155 0.85 PTPRC (0.35) RECQLALDH1A1MMP8ALOX5TAAR1
SCHEMBL7051097 0.81 ALDH1A1 (0.35) RECQLALDH1A1MMP8ALOX5TAAR1
SCHEMBL7051779 0.81 FKBP1A (0.37) ALDH1A1LMNATHRBRAB9A
SCHEMBL7052130 0.80 ALDH1A1 (0.33) RECQLALDH1A1MMP8ALOX5TAAR1
SCHEMBL7046337 0.79 PRNP (0.46) ALDH1A1LMNATHRBSMN1; SMN2MAPT
SCHEMBL7049848 0.79 ALDH1A1 (0.36) RECQLALDH1A1MMP8TAAR1LMNA
SCHEMBL7054000 0.78 ALDH1A1 (0.36) RECQLALDH1A1MMP8TAAR1LMNA

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 RECQL 3066/4885ALDH1A1 465/4885MMP8 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.