SCHEMBL6010285

SCHEMBL6010285

O=C(O)C(Cc1ccc(O)cc1)N(CC(O)CO)CC(O)CO

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.46
ESR1 P03372 3/20 0.41
ESR2 Q92731 3/20 0.41
TRPV1 Q8NER1 1/20 0.40
MME P08473 3/20 0.40
ACE P12821 1/20 0.40
POLB P06746 1/20 0.38
BLM P54132 1/20 0.37
CA2 P00918 1/20 0.37
CAMK2A Q9UQM7 1/20 0.37
FOLH1 Q04609 1/20 0.37
NAALAD2 Q9Y3Q0 1/20 0.37
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35

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
SCHEMBL6010271 1.00 SLC7A5 (0.46) SLC7A5ESR1ESR2TRPV1MME
SCHEMBL6009856 0.88 CYP1A2 (0.46) SLC7A5FOLH1
SCHEMBL6009878 0.88 CYP1A2 (0.46) SLC7A5FOLH1
SCHEMBL7431337 0.81 OPRM1 (0.44) SLC7A5ESR1ESR2TRPV1MME
SCHEMBL14906484 0.80 TRPV1 (0.50) SLC7A5ESR1TRPV1
SCHEMBL6010274 0.78 SLC7A5 (0.43) SLC7A5ESR1ESR2TRPV1MME
SCHEMBL14357545 0.78 SLC7A5 (0.51) SLC7A5ESR1ESR2POLBCA2
SCHEMBL30736141 0.78 SLC7A5 (0.51) SLC7A5ESR1ESR2MMEACE
SCHEMBL6010256 0.76 SLC7A5 (0.46) SLC7A5ESR1ESR2TRPV1MME
SCHEMBL2542276 0.75 SLC7A5 (0.56) SLC7A5ESR1ESR2TRPV1POLB

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 SLC7A5 1780/4885ESR1 4422/4885ESR2 3716/4885

“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.