SCHEMBL2247941

SCHEMBL2247941

Cc1cccc(CNC(=O)[C@H](CCC(=O)O)NC(=O)c2ccc(-c3ccccc3)cc2)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.56
ADAMTS5 Q9UNA0 2/20 0.56
ADAMTS4 O75173 1/20 0.56
CTSB P07858 6/20 0.55
MMP12 P39900 2/20 0.53
MMP8 P22894 1/20 0.53
CTSS P25774 4/20 0.53
CTSK P43235 4/20 0.53
CTSL P07711 3/20 0.53
P2RY12 Q9H244 2/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
KDM1A O60341 3/20 0.51
MAOA P21397 1/20 0.49
PSMB5 P28074 1/20 0.49

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
SCHEMBL3583743 0.89 ADAMTS5 (0.56) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL3576509 0.89 ADAMTS5 (0.62) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL4649972 0.88 HPGD (0.52) MMP2ADAMTS5ADAMTS4CTSBCTSS
SCHEMBL2246985 0.88 ADAMTS5 (0.59) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL2244723 0.87 ADAMTS5 (0.56) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL2246335 0.87 MMP2 (0.58) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL2245471 0.87 MMP2 (0.69) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL2244917 0.87 MMP2 (0.54) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL2247357 0.87 MMP2 (0.61) MMP2ADAMTS5ADAMTS4CTSBMMP12
SCHEMBL7741059 0.87 MMP2 (0.54) MMP2ADAMTS5ADAMTS4CTSBMMP12

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-7553873-B2 Glutamate aggrecanase inhibitors WYETH (US) 2009-06-30 US claimed
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
US-20070043066-A1 Glutamate aggrecanase inhibitors WYETH (US) 2007-02-22 US 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 MMP2 49/4885ADAMTS5 1/4885ADAMTS4 5/4885
US-20070043066-A1 Glutamate aggrecanase inhibitors ADAMTS5, ADAMTS1, ADAMTS7 MMP2 49/4885ADAMTS5 1/4885ADAMTS4 5/4885

“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.