SCHEMBL4915080

SCHEMBL4915080

C[C@@H](O)[C@H](NS(=O)(=O)c1ccc2cccnc2c1)C(=O)NO

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.54
ADAM17 P78536 4/20 0.54
MMP13 P45452 6/20 0.49
MMP9 P14780 5/20 0.49
MMP7 P09237 4/20 0.49
ADAM10 O14672 1/20 0.49
MMP8 P22894 1/20 0.49
MMP14 P50281 1/20 0.49
MMP2 P08253 4/20 0.45
MMP3 P08254 3/20 0.44

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
SCHEMBL14025844 1.00 MMP1 (0.54) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL14045787 0.85 SLC1A3 (0.42) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL4925808 0.83 ADAM17 (0.60) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL14025842 0.83 ADAM17 (0.60) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL20998631 0.76 ALDH1A1 (0.50) MMP1MMP13MMP9MMP8MMP2
SCHEMBL4927229 0.76 MMP1 (0.47) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL5182142 0.76 MMP1 (0.47) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL1770811 0.74 MMP1 (0.67) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL12649188 0.74 MMP1 (0.67) MMP1ADAM17MMP13MMP9MMP7
SCHEMBL4916984 0.73 MMP9 (0.60) MMP1ADAM17MMP13MMP9MMP7

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-20080269282-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2008-10-30 US claimed
US-20070066646-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2007-03-22 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-20080269282-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof AOC2, AOC3, AOC1 MMP1 387/4885ADAM17 1884/4885MMP13 781/4885
US-20070066646-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof AOC2, AOC3, AOC1 MMP1 510/4885ADAM17 2174/4885MMP13 898/4885

“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.