SCHEMBL2172900

SCHEMBL2172900

COC(=O)[C@H]1C[C@H](OC(=O)N2CCCC2)CN[C@@H]1C(=O)N1CC=C(c2ccccc2)CC1

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 18/20 0.81
ERBB2 P04626 14/20 0.81
MMP2 P08253 13/20 0.81
MMP9 P14780 7/20 0.81
MMP1 P03956 3/20 0.54
MMP3 P08254 4/20 0.47
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
MMP12 P39900 1/20 0.42
MMP14 P50281 1/20 0.42
ADAM8 P78325 1/20 0.42
ADAM17 P78536 1/20 0.42
ADAM33 Q9BZ11 1/20 0.42

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
SCHEMBL3457112 0.91 ADAM10 (0.83) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2174554 0.89 ADAM10 (1.00) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2174547 0.89 ADAM10 (1.00) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2174756 0.89 ADAM10 (1.00) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2172157 0.88 ADAM10 (0.96) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2172170 0.88 ADAM10 (0.96) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2174460 0.82 ADAM10 (1.00) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2174466 0.82 ADAM10 (1.00) ADAM10ERBB2MMP2MMP9MMP1
SCHEMBL2172713 0.81 ADAM10 (0.57) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2172725 0.81 ADAM10 (0.57) ADAM10ERBB2MMP2MMP9MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9440958-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2016-09-13 US disclosed
US-20110224189-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES INCYTE CORPORATION 2011-09-15 US disclosed
US-7973041-B2 Antiarthritic agents; psoriasis; anticancer agents;antiallergens; metalloprotease inhibitors. INCYTE CORPORATION (US) 2011-07-05 US disclosed
US-7491724-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2009-02-17 US disclosed
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION 2005-05-26 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-20110224189-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES MMP25, MMP14, MMP9 ADAM10 25/4885ERBB2 2986/4885MMP2 4/4885
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases MMP25, MMP2, MMP14 ADAM10 26/4885ERBB2 3036/4885MMP2 2/4885

“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.