SCHEMBL6435813

SCHEMBL6435813

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nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 9/20 0.48
MMP9 P14780 9/20 0.48
MMP3 P08254 7/20 0.48
MMP1 P03956 6/20 0.48
MMP8 P22894 5/20 0.48
MMP14 P50281 3/20 0.48
MMP13 P45452 2/20 0.48
ADAM17 P78536 1/20 0.48
PDF Q9HBH1 1/20 0.40
DPP4 P27487 2/20 0.37
FCER2 P06734 1/20 0.37
BIRC2 Q13490 3/20 0.36
MMP7 P09237 2/20 0.36
MMP12 P39900 1/20 0.36
LTA4H P09960 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
SCHEMBL9714184 0.84 DPP4 (0.40) MMP2MMP9MMP3MMP1MMP8
SCHEMBL9714104 0.80 DPP4 (0.36) DPP4
SCHEMBL9714153 0.75 MMP1 (0.49) MMP2MMP9MMP3MMP1MMP8
SCHEMBL14068125 0.73 MMP2 (0.59) MMP2MMP9MMP3MMP1MMP8
SCHEMBL9714049 0.72 MMP2 (0.46) MMP2MMP9MMP3MMP1MMP8
SCHEMBL9714087 0.71 MMP1 (0.41) MMP2MMP9MMP3MMP1MMP8
SCHEMBL8890070 0.70 MMP2 (0.54) MMP2MMP9MMP3MMP1MMP8
SCHEMBL7426952 0.70 MMP2 (0.54) MMP2MMP9MMP3MMP1MMP8
SCHEMBL7073422 0.69 MMP2 (0.50) MMP2MMP9MMP3MMP1MMP8
SCHEMBL8601655 0.68 MMP2 (0.65) MMP2MMP9MMP3MMP1MMP8

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-20050020607-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2005-01-27 US disclosed
EP-1047450-B1 ACE INHIBITOR-MMP INHIBITOR COMBINATIONS WARNER LAMBERT CO (US) 2002-10-02 EP disclosed
US-20020049237-A1 Statin-MMP inhibitor combinations NEWTON ROGER SCHOFIELD (US) 2002-04-25 US disclosed
US-6340709-B1 ADMINISTERING BIPHENYLSULFONAMIDE DERIVATIVE WARNER-LAMBERT COMPANY 2002-01-22 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-20050020607-A1 Statin-MMP inhibitor combinations MMP9, TIMP3, MMP3 MMP2 19/4885MMP9 1/4885MMP3 3/4885
US-20020049237-A1 Statin-MMP inhibitor combinations MMP9, TIMP3, MMP3 MMP2 19/4885MMP9 1/4885MMP3 3/4885

“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.