SCHEMBL4920717

SCHEMBL4920717

CC(NC(=O)CCC(=O)NO)c1ccc2ccccc2c1

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 1/20 0.68
HDAC1 Q13547 4/20 0.58
HDAC8 Q9BY41 3/20 0.58
HCRTR1 O43613 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
F7 P08709 2/20 0.50
F2 P00734 1/20 0.50
F10 P00742 1/20 0.50
ALOX5 P09917 1/20 0.50
PDE2A O00408 1/20 0.48

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
SCHEMBL18137208 0.89 MMP9 (0.59) MMP9HCRTR1TDP1F7F2
SCHEMBL7931673 0.84 MMP9 (0.64) MMP9HCRTR1TDP1F7F2
SCHEMBL1143366 0.84 MMP9 (0.64) MMP9HCRTR1TDP1F7F2
SCHEMBL3523094 0.84 MMP9 (0.64) MMP9HCRTR1TDP1F7F2
SCHEMBL18068729 0.84 MMP9 (0.64) MMP9HCRTR1TDP1F7F2
SCHEMBL4037714 0.82 ALDH1A1 (0.64) MMP9HCRTR1TDP1F7F2
SCHEMBL4857933 0.82 ALDH1A1 (0.64) MMP9HCRTR1TDP1F7F2
SCHEMBL9686076 0.82 MMP9 (0.75) MMP9HCRTR1TDP1F7F2
SCHEMBL12354758 0.81 MMP9 (0.61) MMP9HCRTR1TDP1F7F2
SCHEMBL9002961 0.81 ALDH1A1 (0.68) MMP9HCRTR1TDP1

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-20080269282-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2008-10-30 US claimed
US-20080269282-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2008-10-30 US disclosed
US-20070066646-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2007-03-22 US disclosed
US-20070066646-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof GENMEDICA THERAPEUTICS SL (ES) 2007-03-22 US disclosed
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 MMP9 856/4885HDAC1 563/4885HDAC8 3399/4885
US-20070066646-A1 Compounds for Inhibiting Copper-Containing Amine Oxidases and Uses Thereof AOC2, AOC3, AOC1 MMP9 1037/4885HDAC1 622/4885HDAC8 3570/4885

“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.