SCHEMBL13613766

SCHEMBL13613766

C=CCOC(=O)N[C@@H](COCc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.57
FOLH1 Q04609 1/20 0.55
CASP1 P29466 11/20 0.54
PPARG P37231 1/20 0.52
ALDH1A1 P00352 1/20 0.50
MME P08473 1/20 0.49
CTSS P25774 2/20 0.46
CTSL P07711 1/20 0.46
CTSK P43235 1/20 0.46

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
SCHEMBL28836239 1.00 PPARA (0.57) PPARAFOLH1CASP1PPARGALDH1A1
SCHEMBL24448342 0.90 PPARA (0.51) PPARAFOLH1CASP1PPARGCTSS
SCHEMBL8202407 0.90 PPARA (0.51) PPARAFOLH1CASP1PPARGCTSS
SCHEMBL28595041 0.86 PPARA (0.64) PPARAFOLH1CASP1PPARGALDH1A1
SCHEMBL1171673 0.86 PPARA (0.64) PPARAFOLH1CASP1PPARGALDH1A1
SCHEMBL1024175 0.86 PPARA (0.64) PPARAFOLH1CASP1PPARGALDH1A1
SCHEMBL27474758 0.86 CASP1 (0.49) PPARAFOLH1CASP1ALDH1A1CTSS
SCHEMBL27490859 0.85 CASP1 (0.48) CASP1ALDH1A1CTSSCTSLCTSK
SCHEMBL10884777 0.84 ALDH1A1 (0.63) CASP1ALDH1A1MME
SCHEMBL2977396 0.84 ALDH1A1 (0.63) CASP1ALDH1A1MME

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115053184-B Composition for forming EUV resist underlayer film 日产化学株式会社 2024-12-06 CN disclosed
CN-115053184-A Composition for forming EUV resist underlayer film 日产化学株式会社 2022-09-13 CN disclosed
US-20090275727-A1 Peptide turn mimetics MIMETICA PTY LIMITED (AU) 2009-11-05 US disclosed
US-20090275727-A1 Peptide turn mimetics MIMETICA PTY LIMITED (AU) 2009-11-05 US 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-20090275727-A1 Peptide turn mimetics IAPP, GLP1R, VIP PPARA 4156/4885FOLH1 364/4885CASP1 1995/4885

“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.