SCHEMBL6009831

SCHEMBL6009831

O=C(NC(CO)C(=O)O)C(O)CO

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.52
OR51E2 Q9H255 1/20 0.50
MME P08473 7/20 0.49
ACE P12821 1/20 0.39
CA2 P00918 3/20 0.39
CA1 P00915 2/20 0.39
FOLH1 Q04609 1/20 0.34
RIMKLA Q8IXN7 1/20 0.34
NAALAD2 Q9Y3Q0 1/20 0.34

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
SCHEMBL7070376 1.00 TGFBR1 (0.52) TGFBR1OR51E2MMEACECA2
SCHEMBL6253538 0.89 ACE (0.49) TGFBR1OR51E2MMEACECA2
SCHEMBL2633846 0.87 ACE (0.47) TGFBR1OR51E2MMEACECA2
SCHEMBL28806122 0.85 OR51E2 (0.44) TGFBR1OR51E2MMEACEFOLH1
SCHEMBL8491732 0.85 OR51E2 (0.44) TGFBR1OR51E2MMEACEFOLH1
SCHEMBL4363673 0.85 ACE (0.58) TGFBR1OR51E2MMEACECA2
SCHEMBL321602 0.85 ACE (0.58) TGFBR1OR51E2MMEACECA2
SCHEMBL29837094 0.85 OR51E2 (0.44) TGFBR1OR51E2MMEACEFOLH1
SCHEMBL8216927 0.85 ACE (0.58) TGFBR1OR51E2MMEACECA2
SCHEMBL8491734 0.85 OR51E2 (0.44) TGFBR1OR51E2MMEACEFOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060018864-A1 Cosmetic preparation containing glycerylamino acid derivative SEIWA KASEI COMPANY, LIMITED (JP) 2006-01-26 US disclosed
EP-1584320-A1 COSMETIC PREPARATION CONTAINING GLYCERYLAMINO ACID DERIVATIVE Seiwa Kasei Company, Limited (JP) 2005-10-12 EP disclosed
US-5998362-A OLIGOPEPTIDES, HAVING AMINO ACID SEQUENCES THAT ARE SELECTIVELY PROTEOLYTICALLY CLEAVED BY FREE PROSTATE SPECIFIC ANTIGEN (PSA), HYDROPHILIC OLIGOPEPTIDE BLOCKING GROUPS MERCK & CO., INC. (US) 1999-12-07 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-20060018864-A1 Cosmetic preparation containing glycerylamino acid derivative GLA, GPKOW, CUTA TGFBR1 4512/4885OR51E2 2335/4885MME 2180/4885

“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.