SCHEMBL2174880

SCHEMBL2174880

CC(C)c1cccc(C2CCN(C(=O)[C@@H]3[C@@H](C(=O)NO)CCCN3C(=O)OC3CCOCC3)CC2)c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 16/20 0.51
ERBB2 P04626 9/20 0.51
MMP2 P08253 13/20 0.51
MMP9 P14780 6/20 0.48
MMP3 P08254 5/20 0.48
MMP8 P22894 1/20 0.44
MMP12 P39900 1/20 0.44
ADAM17 P78536 1/20 0.44
F2R P25116 1/20 0.39
BCL9 O00512 1/20 0.37
CTNNB1 P35222 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
HCRTR2 O43614 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
SCHEMBL2172866 0.95 ADAM10 (0.50) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2172699 0.95 ADAM10 (0.50) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL27671825 0.85 ADAM10 (0.59) ADAM10ERBB2MMP2MMP9MMP8
SCHEMBL3457278 0.85 ADAM10 (0.59) ADAM10ERBB2MMP2MMP9MMP8
SCHEMBL2177281 0.78 ADAM10 (0.73) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2173634 0.75 ADAM10 (0.49) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2174465 0.74 ADAM10 (0.68) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2174747 0.71 ADAM10 (0.55) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2174485 0.71 ADAM10 (0.65) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2174883 0.69 ADAM10 (0.46) ADAM10ERBB2MMP2MMP9F2R

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 9 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 claimed
US-20110224189-A1 SUBSTITUTED CYCLIC HYDROXAMATES AS INHIBITORS OF MATRIX METALLOPROTEINASES INCYTE CORPORATION 2011-09-15 US claimed
US-20050113344-A1 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION 2005-05-26 US claimed
US-9440958-B2 Substituted cyclic hydroxamates as inhibitors of matrix metalloproteinases INCYTE CORPORATION (US) 2016-09-13 US disclosed
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
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.