SCHEMBL6009834

SCHEMBL6009834

O=C(O)[C@H](CO)NOCC(O)CO

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TGFBR1 P36897 3/20 0.40
OR51E2 Q9H255 1/20 0.34
MME P08473 5/20 0.33
CA2 P00918 3/20 0.33
CA1 P00915 2/20 0.33
LMNA P02545 2/20 0.33
KDM4E B2RXH2 1/20 0.33
DUSP3 P51452 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL6009842 0.87 KDM4E (0.40) TGFBR1OR51E2MMELMNAKDM4E
SCHEMBL6009597 0.85 ITGB1 (0.33) TGFBR1OR51E2
SCHEMBL6010454 0.84 FOLH1 (0.46)
SCHEMBL6010366 0.84 ALDH1A1 (0.44) MMELMNAMEN1KMT2AALDH1A1
SCHEMBL27259500 0.84 TGFBR1 (0.37) TGFBR1CA2CA1KDM4EMEN1
SCHEMBL6009547 0.83 FOLH1 (0.44)
SCHEMBL6010380 0.81 FOLH1 (0.39) TGFBR1LMNAKDM4EDUSP3MEN1
SCHEMBL28491840 0.81 KMT2A (0.38) TGFBR1CA2CA1LMNAKDM4E
SCHEMBL6010244 0.80 MAPK1 (0.41) CA2CA1LMNAKDM4EALDH1A1
SCHEMBL6009533 0.80 FOLH1 (0.44) CA2CA1

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 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.