SCHEMBL2249339

SCHEMBL2249339

CC(C)(Cc1ccc(F)cc1)N(C(=O)c1ccc(-c2ccco2)cc1)[C@@H](CCC(N)=O)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 18/20 0.42
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
PPARA Q07869 1/20 0.38
MMP2 P08253 1/20 0.36
MMP8 P22894 1/20 0.36
MMP12 P39900 1/20 0.36
ADAMTS5 Q9UNA0 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
SCHEMBL2245193 0.87 MMP2 (0.43) TP53MAPTMMP2MMP8MMP12
SCHEMBL2247913 0.85 MMP2 (0.39) MMP2MMP8MMP12ADAMTS5
SCHEMBL2248296 0.84 MMP2 (0.40) PPARAMMP2MMP8MMP12ADAMTS5
SCHEMBL2251479 0.82 DRD2 (0.39) MAPTPPARAMMP2MMP8MMP12
SCHEMBL2245312 0.82 HSD17B1 (0.43) MMP2MMP8MMP12ADAMTS5
SCHEMBL2248091 0.82 HSD17B2 (0.41) PPARAMMP2MMP8MMP12ADAMTS5
SCHEMBL2247162 0.82 MMP2 (0.37) MMP2MMP8MMP12ADAMTS5
SCHEMBL2247786 0.82 HSD17B2 (0.46) MMP2MMP8MMP12ADAMTS5
SCHEMBL2244705 0.81 RXRA (0.42) MMP2MMP8MMP12ADAMTS5
SCHEMBL2245867 0.81 MMP2 (0.40) MAPTMMP2MMP8MMP12ADAMTS5

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070043066-A1 Glutamate aggrecanase inhibitors WYETH (US) 2007-02-22 US claimed
US-7998965-B2 Glutamate aggrecanase inhibitors WYETH LLC (US) 2011-08-16 US disclosed
US-20100010012-A1 GLUTAMATE AGGRECANASE INHIBITORS WYETH (US) 2010-01-14 US disclosed
US-7553873-B2 Glutamate aggrecanase inhibitors WYETH (US) 2009-06-30 US disclosed
EP-1902014-A2 GLUTAMATE AGGRECANASE INHIBITORS Wyeth (US) 2008-03-26 EP disclosed
US-20070043066-A1 Glutamate aggrecanase inhibitors WYETH (US) 2007-02-22 US disclosed
WO-2007008994-A2 GLUTAMATE AGGRECANASE INHIBITORS WYETH (US) 2007-01-18 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 (2 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-20100010012-A1 GLUTAMATE AGGRECANASE INHIBITORS ADAMTS5, ADAMTS1, ADAMTS7 PPARD 3286/4885TP53 4136/4885MAPT 1544/4885
US-20070043066-A1 Glutamate aggrecanase inhibitors ADAMTS5, ADAMTS1, ADAMTS7 PPARD 3286/4885TP53 4136/4885MAPT 1544/4885

“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.