SCHEMBL2174562

SCHEMBL2174562

CC(C)c1cccc(C2=CCN(C(=O)C3NCCCC3C(=O)OC(C)(C)C)CC2)c1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 14/20 0.56
MMP2 P08253 11/20 0.56
MMP9 P14780 6/20 0.56
MMP3 P08254 3/20 0.56
MMP1 P03956 2/20 0.43
ERBB2 P04626 7/20 0.41
CDK7 P50613 1/20 0.41
CDK13 Q14004 1/20 0.41
CDK12 Q9NYV4 1/20 0.41
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
PDK4 Q16654 1/20 0.37
KCNH2 Q12809 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
SOS1 Q07889 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
SCHEMBL2173311 0.81 ADAM10 (0.56) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL24721099 0.78 PDK4 (0.57) ADAM10MMP2MMP9MMP3CDK7
SCHEMBL2175276 0.74 ADAM10 (0.83) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL2171652 0.73 ADAM10 (0.71) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL2175433 0.73 ADAM10 (0.71) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL2173781 0.72 ADAM10 (0.70) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL1366118 0.72 ADAM10 (1.00) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL1364108 0.72 ADAM10 (1.00) ADAM10MMP2MMP9MMP3MMP1
SCHEMBL2172841 0.71 ADAM10 (0.53) ADAM10MMP2MMP9MMP3ALDH1A1
SCHEMBL24721255 0.71 QDPR (0.60) ADAM10MMP2MMP9MMP3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853243-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2014-10-07 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
EP-2264030-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases Incyte Corporation (US) 2010-12-22 EP disclosed
US-7491724-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2009-02-17 US disclosed
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases LNCYTE CORPORATION (US) 2008-07-10 US disclosed
CN-1898234-A Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORP (US) 2007-01-17 CN 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 (3 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 25/4885MMP2 4/4885MMP9 3/4885
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases MMP25, MMP9, MMP24 ADAM10 25/4885MMP2 5/4885MMP9 2/4885
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases MMP25, MMP2, MMP14 ADAM10 26/4885MMP2 2/4885MMP9 4/4885

“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.