SCHEMBL6010225

SCHEMBL6010225

NC(CSSCC(C(=O)O)N(C(=O)C(O)CO)C(=O)C(O)CO)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.35
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
GRM1 Q13255 1/20 0.33
GRM2 Q14416 1/20 0.33
SLC1A1 P43005 1/20 0.33
NOS2 P35228 3/20 0.33
NOS1 P29475 2/20 0.33
NOS3 P29474 1/20 0.33
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
ALDH1A1 P00352 1/20 0.30
ALOX15 P16050 1/20 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
SCHEMBL20489327 0.81 NOS2 (0.37) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL26087006 0.81 NOS2 (0.37) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL9433207 0.80 ARG1 (0.38) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL14645245 0.78 NOS2 (0.40) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL14645243 0.78 NOS2 (0.40) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL14645246 0.78 NOS2 (0.40) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL9810237 0.77 SLC7A5 (0.50) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL9810241 0.77 SLC7A5 (0.50) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL111218 0.77 NOS2 (0.42) GRIK1GRIK2GRM1GRM2SLC1A1
SCHEMBL111219 0.77 NOS2 (0.42) GRIK1GRIK2GRM1GRM2SLC1A1

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 2335/4885GRIK1 987/4885GRIK2 744/4885

“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.