SCHEMBL6010163

SCHEMBL6010163

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

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.39
LMNA P02545 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SLC22A6 Q4U2R8 1/20 0.35
SMPD2 O60906 1/20 0.33
PDE4A P27815 1/20 0.32
USP2 O75604 1/20 0.30
SLCO1B1 Q9Y6L6 1/20 0.30
GABRR1 P24046 2/20 0.30
MMP1 P03956 1/20 0.30
MMP7 P09237 1/20 0.30
MMP8 P22894 1/20 0.30
MMP12 P39900 1/20 0.30
MMP13 P45452 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
SCHEMBL6010151 1.00 OR51E2 (0.39) OR51E2LMNAALDH1A1SLC22A6SMPD2
SCHEMBL6275148 0.87 OR51E2 (0.36) OR51E2LMNAALDH1A1PDE4A
SCHEMBL6275155 0.87 OR51E2 (0.36) OR51E2LMNAALDH1A1PDE4A
SCHEMBL7777306 0.85 SLC22A6 (0.41) OR51E2LMNAALDH1A1SLC22A6GABRR1
SCHEMBL6009581 0.82 RNPEP (0.36) OR51E2LMNAALDH1A1
SCHEMBL7777310 0.82 OR51E2 (0.32) OR51E2
SCHEMBL6009490 0.82 TET2 (0.42) OR51E2
SCHEMBL6009481 0.82 TET2 (0.42) OR51E2
SCHEMBL6009571 0.82 RNPEP (0.36) OR51E2LMNAALDH1A1
SCHEMBL6009873 0.79 CPB2 (0.38) OR51E2GABRR1

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 2335/4885LMNA 1546/4885ALDH1A1 819/4885

“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.