SCHEMBL2247337

SCHEMBL2247337

CCCNC(=O)C(CCC(=O)O)NC(=O)c1ccc2c(c1)C(=O)c1ccccc1-2

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.52
PTPRC P08575 2/20 0.51
CTSL P07711 1/20 0.51
PTPN13 Q12923 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL3587576 0.92 CCKBR (0.51) CCKBR
SCHEMBL2247862 0.87 CCKBR (0.51) CCKBRPTPRCCTSLPTPN13
SCHEMBL3589250 0.86 PTPRC (0.52) CCKBRPTPRCCTSLPTPN13
SCHEMBL2246128 0.85 CCKBR (0.50) CCKBRL3MBTL1
SCHEMBL2245265 0.83 L3MBTL1 (0.72) CCKBRL3MBTL1
SCHEMBL2249422 0.82 HPGDS (0.59) PTPRCCTSLPTPN13
SCHEMBL2247265 0.80 MMP2 (0.63) PTPRCCTSLPTPN13
SCHEMBL2247972 0.78 CCKBR (0.49) CCKBR
SCHEMBL4622305 0.77 CCKBR (0.50) CCKBRPTPRCCTSLPTPN13
SCHEMBL2250363 0.77 L3MBTL1 (0.62) L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 CCKBR 2177/4885PTPRC 2656/4885CTSL 294/4885
US-20070043066-A1 Glutamate aggrecanase inhibitors ADAMTS5, ADAMTS1, ADAMTS7 CCKBR 2177/4885PTPRC 2656/4885CTSL 294/4885

“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.