SCHEMBL4582217

SCHEMBL4582217

CC(=O)OCC(CNC(=O)c1cc(C(=O)NCC(COC(C)=O)OC(C)=O)cc([N+](=O)[O-])c1)OC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.48
ABCB1 P08183 1/20 0.45
LMNA P02545 4/20 0.45
MAPT P10636 3/20 0.45
ATM Q13315 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
HTT P42858 3/20 0.44
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PKM P14618 1/20 0.39

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
SCHEMBL9566637 0.94 SMN1; SMN2 (0.45) GAAABCB1LMNAMAPTATM
SCHEMBL12871748 0.90 GAA (0.43) GAAABCB1LMNAMAPTATM
SCHEMBL4580348 0.82 ABCB1 (0.48) GAAABCB1LMNAMEN1KMT2A
SCHEMBL4579151 0.78 MAPT (0.47) GAALMNAMAPTMEN1KMT2A
SCHEMBL30732620 0.78 ABCB1 (0.46) GAAABCB1KMT2AALDH1A1L3MBTL1
SCHEMBL30732527 0.77 ABCB1 (0.54) GAAABCB1MAPTKMT2AHTT
SCHEMBL4615298 0.76 ABCB1 (0.43) GAAABCB1LMNAMAPTMEN1
SCHEMBL11224199 0.76 GAA (0.42) GAAABCB1LMNAMAPTMEN1
SCHEMBL6865356 0.74 GAA (0.51) GAALMNAMAPTATMMEN1
SCHEMBL12871755 0.74 ATM (0.42) GAALMNAMAPTATMMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7351389-B2 Aminocarboxylate ligands having substituted aromatic amide moieties BRACCO INTERNATIONAL B.V. (NL) 2008-04-01 US disclosed
US-7351389-B2 Aminocarboxylate ligands having substituted aromatic amide moieties BRACCO INTERNATIONAL B.V. (NL) 2008-04-01 US disclosed
US-20050090689-A1 Aminocarboxylate ligands having substituted aromatic amide moieties BRACCO INTERNATIONAL B.V. (NL) 2005-04-28 US disclosed
US-6875864-B2 Aminocarboxylate ligands having substituted aromatic amide moieties BRACCO INTERNATIONAL B.V. (NL) 2005-04-05 US disclosed
US-20030171561-A1 Aminocarboxylate ligands having substituted aromatic amide moieties BRACCO SUISSE SA (CH) 2003-09-11 US disclosed
EP-0543482-B1 Aminocarboxylate ligands having substituted aromatic amide moieties BRACCO INT BV (NL) 2002-02-06 EP 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-20030171561-A1 Aminocarboxylate ligands having substituted aromatic amide moieties ARGLU1, PRMT1, AADAC GAA 4341/4885ABCB1 1927/4885LMNA 3524/4885
US-20050090689-A1 Aminocarboxylate ligands having substituted aromatic amide moieties AADAC, ANXA3, AAAS GAA 3645/4885ABCB1 1331/4885LMNA 2658/4885

“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.