SCHEMBL2176925

SCHEMBL2176925

COC(=O)[C@H]1C[C@H](OC2CCN(C(C)=O)CC2)CC[C@@H]1C(=O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 16/20 0.49
ERBB2 P04626 16/20 0.49
MMP2 P08253 16/20 0.49
SIGMAR1 Q99720 1/20 0.47
NAMPT P43490 1/20 0.46
CTSB P07858 2/20 0.46
CTSS P25774 2/20 0.46
CTSK P43235 2/20 0.46
MMP9 P14780 11/20 0.45
MMP3 P08254 6/20 0.45

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
SCHEMBL3457449 0.92 SIGMAR1 (0.49) ADAM10ERBB2MMP2SIGMAR1NAMPT
SCHEMBL2172688 0.90 ADAM10 (0.61) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2173742 0.83 ADAM10 (0.60) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2172052 0.83 ADAM10 (0.53) ADAM10ERBB2MMP2SIGMAR1CTSB
SCHEMBL2174896 0.81 ADAM10 (0.64) ADAM10ERBB2MMP2MMP9MMP3
SCHEMBL2172824 0.80 ADAM10 (0.57) ADAM10ERBB2MMP2SIGMAR1CTSB
SCHEMBL2173711 0.80 ADAM10 (0.57) ADAM10ERBB2MMP2SIGMAR1CTSB
SCHEMBL27671953 0.80 ADAM10 (0.57) ADAM10ERBB2MMP2SIGMAR1CTSB
SCHEMBL2175620 0.78 EPHX2 (0.35)
SCHEMBL2173866 0.78 ADAM10 (0.59) 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.