SCHEMBL6009515

SCHEMBL6009515

CC(C)C(C(=O)O)N(C(=O)C(O)CO)C(=O)C(O)CO

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.44
TP53 P04637 1/20 0.33
GABRR1 P24046 2/20 0.30

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
SCHEMBL6009512 0.88 OR51E2 (0.44) OR51E2TP53
SCHEMBL6010176 0.83 OR51E2 (0.40) OR51E2TP53
SCHEMBL6010336 0.79 OR51E2 (0.48) OR51E2TP53
SCHEMBL6009565 0.73 OR51E2 (0.41) OR51E2
SCHEMBL6010143 0.72 OR51E2 (0.50) OR51E2GABRR1
SCHEMBL31116850 0.71 SLC7A5 (0.52) TP53GABRR1
SCHEMBL3066899 0.69 SLC7A5 (0.55)
SCHEMBL15756827 0.68 GABRR1 (0.38) OR51E2TP53GABRR1
SCHEMBL6009538 0.68 OR51E2 (0.34) OR51E2TP53GABRR1
SCHEMBL6009521 0.68 OR51E2 (0.34) OR51E2TP53GABRR1

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-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

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 OR51E2 2335/4885TP53 1525/4885GABRR1 2260/4885

“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.