SCHEMBL2173409

SCHEMBL2173409

O=C(NO)C1C[C@@](OC(=O)C(F)(F)F)(c2ccccc2)CCC1C(=O)N1CCN(c2ccccc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADAM10 O14672 18/20 0.64
MMP2 P08253 16/20 0.64
ERBB2 P04626 16/20 0.64
MMP9 P14780 10/20 0.64
MMP3 P08254 3/20 0.46
CTSB P07858 2/20 0.45
CTSS P25774 2/20 0.45
CTSK P43235 2/20 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
SCHEMBL2177025 1.00 ADAM10 (0.64) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2174364 0.86 ADAM10 (0.63) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2176086 0.85 ADAM10 (0.61) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2177249 0.85 ADAM10 (0.61) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2173828 0.84 ADAM10 (0.60) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2174820 0.84 ADAM10 (0.63) ADAM10MMP2ERBB2MMP9MMP3
Trifluoroacetic Acid SCHEMBL2177021 0.83 ADAM10 (0.67) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2175012 0.83 ADAM10 (0.58) ADAM10MMP2ERBB2MMP9MMP3
SCHEMBL2174572 0.83 ADAM10 (0.58) ADAM10MMP2ERBB2MMP9MMP3
Trifluoroacetic Acid SCHEMBL2174362 0.79 ADAM10 (0.67) ADAM10MMP2ERBB2MMP9MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7973041-B2 Antiarthritic agents; psoriasis; anticancer agents;antiallergens; metalloprotease inhibitors. INCYTE CORPORATION (US) 2011-07-05 US disclosed
US-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases LNCYTE CORPORATION (US) 2008-07-10 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 (1 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-20080167288-A1 Substituted cyclic hydroxamates as lnhibitors of matrix metalloproteinases MMP25, MMP9, MMP24 ADAM10 25/4885MMP2 5/4885ERBB2 3033/4885

“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.