SCHEMBL13253276

SCHEMBL13253276

CNC(=O)[C@H](Cc1ccc(NC(=N)N)cc1)NC(=O)[C@H](CC(C)C)[C@H](CCCc1ccccc1)C(=O)NO

nearest known ligand 0.76

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 12/20 0.76
MMP13 P45452 3/20 0.76
FCER2 P06734 13/20 0.61
MMP2 P08253 7/20 0.60
MMP3 P08254 6/20 0.60
MMP7 P09237 4/20 0.59
MMP8 P22894 3/20 0.59
ADAM17 P78536 3/20 0.59
MMP9 P14780 2/20 0.59
MMP14 P50281 2/20 0.59
MMP12 P39900 1/20 0.59

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
SCHEMBL3503805 1.00 MMP1 (0.76) MMP1MMP13FCER2MMP2MMP3
SCHEMBL30035567 0.86 MMP1 (1.00) MMP1MMP13FCER2MMP2MMP3
SCHEMBL3503807 0.85 MMP1 (0.75) MMP1MMP13FCER2MMP2MMP3
SCHEMBL7855580 0.78 MMP1 (0.62) MMP1MMP13FCER2MMP2MMP3
SCHEMBL6851738 0.77 MMP1 (0.66) MMP1MMP13FCER2MMP2MMP3
SCHEMBL15505966 0.76 MMP1 (1.00) MMP1MMP13FCER2MMP2MMP3
SCHEMBL9714201 0.76 ADAM17 (0.67) MMP1MMP13MMP2MMP3MMP7
SCHEMBL7406329 0.75 MMP1 (0.80) MMP1MMP13FCER2MMP2MMP3
SCHEMBL13274148 0.75 MMP2 (1.00) MMP1MMP13FCER2MMP2MMP3
SCHEMBL1844243 0.75 MMP2 (1.00) MMP1MMP13FCER2MMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100168089-A1 UTILIZATION OF TACE INHIBITORS FOR THE TREATMENT OF ACNE GALDERMA RESEARCH & DEVELOPMENT (FR) 2010-07-01 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-20100168089-A1 UTILIZATION OF TACE INHIBITORS FOR THE TREATMENT OF ACNE MMP17, MMP25, TIMP3 MMP1 16/4885MMP13 18/4885FCER2 3711/4885

“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.