SCHEMBL7769148

SCHEMBL7769148

O=C(CI)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE P12821 7/20 0.62
FOLH1 Q04609 1/20 0.60
NAALAD2 Q9Y3Q0 1/20 0.60
MME P08473 5/20 0.56
CPA1 P15085 1/20 0.55
ACE2 Q9BYF1 1/20 0.55
CA1 P00915 3/20 0.53
CA2 P00918 3/20 0.53
SLC7A5 Q01650 1/20 0.50
ALB P02768 1/20 0.49
IL2 P60568 1/20 0.49
NHERF1 O14745 1/20 0.49

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
SCHEMBL7769146 1.00 ACE (0.62) ACEFOLH1NAALAD2MMECPA1
SCHEMBL6306316 0.90 ACE (0.62) ACEFOLH1NAALAD2MMECPA1
SCHEMBL4161387 0.87 ACE (0.62) ACEFOLH1NAALAD2MMECPA1
SCHEMBL4161392 0.87 ACE (0.62) ACEFOLH1NAALAD2MMECPA1
SCHEMBL1991725 0.87 ACE (0.62) ACEFOLH1NAALAD2MMECPA1
SCHEMBL1991726 0.87 ACE (0.62) ACEFOLH1NAALAD2MMECPA1
SCHEMBL21777173 0.86 MME (0.61) ACENAALAD2MMECPA1ACE2
SCHEMBL6757142 0.85 PTPN2 (0.52) ACEFOLH1NAALAD2CA1SLC7A5
SCHEMBL3459805 0.85 ACE (0.60) ACEFOLH1NAALAD2MMECPA1
SCHEMBL16892795 0.85 ACE (0.60) ACEFOLH1NAALAD2MMECPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000077520-A1 LABELLING OF PEPTIDES AND PROTEINS PROTEOSYS AG (DE) 2000-12-21 WO claimed
EP-1059531-A1 Labelling of peptides and proteins Nordheim, Alfred, Prof. Dr. (DE) 2000-12-13 EP claimed
CN-115515928-B Method for analyzing polysulfide, method for inhibiting hydrolysis of polysulfide, and use of N-iodoacetyl-L-tyrosine methyl ester 公立大学法人大阪 2024-05-10 CN disclosed
US-20230147021-A1 POLYSULFIDE STABILIZATION UNIVERSITY PUBLIC CORPORATION OSAKA (JP) 2023-05-11 US disclosed
CN-115515928-A Stabilization of polysulfides 公立大学法人大阪 2022-12-23 CN disclosed
WO-2001094945-A2 METHOD FOR ENHANCING THE SOLUBILITY OF PROTEINS BY ALKYLATING REAGENTS PROTEOSYS AG (DE) 2001-12-13 WO disclosed
WO-2000077520-A1 LABELLING OF PEPTIDES AND PROTEINS PROTEOSYS AG (DE) 2000-12-21 WO disclosed
EP-1059531-A1 Labelling of peptides and proteins Nordheim, Alfred, Prof. Dr. (DE) 2000-12-13 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 (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-20230147021-A1 POLYSULFIDE STABILIZATION YWHAZ, YWHAH, PTPN21 ACE 3452/4885FOLH1 2950/4885NAALAD2 2538/4885

“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.