SCHEMBL6906580

SCHEMBL6906580

CCC(=O)N(CC(=O)O)c1ccc(OC(C)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.43
ELANE P08246 2/20 0.42
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 3/20 0.41
MAPT P10636 2/20 0.41
HSP90AA1 P07900 1/20 0.41
GAA P10253 1/20 0.41
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
KMT2A Q03164 3/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6907641 0.87 LMNA (0.42) LMNAELANEHSD17B10ALDH1A1MAPT
SCHEMBL6902198 0.86 LMNA (0.47) LMNAELANEHSD17B10ALDH1A1MAPT
SCHEMBL6905596 0.85 LMNA (0.45) LMNAELANEALDH1A1MAPTGAA
SCHEMBL6904246 0.85 ALDH1A1 (0.42) LMNAELANEHSD17B10ALDH1A1MAPT
SCHEMBL6907387 0.83 LMNA (0.45) LMNAHSD17B10ALDH1A1KMT2AKDM4E
SCHEMBL6905457 0.82 LMNA (0.38) LMNAELANEHSD17B10ALDH1A1MAPT
SCHEMBL6470863 0.79 ESR1 (0.41) ALDH1A1
SCHEMBL6470937 0.79 ALDH1A1 (0.55) ALDH1A1KMT2AMEN1
SCHEMBL6902830 0.78 LMNA (0.46) LMNAELANEHSD17B10ALDH1A1MAPT
SCHEMBL6905698 0.75 LMNA (0.46) LMNAELANEHSD17B10ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6824786-B2 TOPICAL APPLYING COSMETIC YU RUEY J (US) 2004-11-30 US claimed
EP-1455734-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES Yu, Ruey J., Dr. (US) 2004-09-15 EP claimed
US-20030108496-A1 Compositions comprising phenyl-glycine derivatives YU RUEY J (US) 2003-06-12 US claimed
WO-2003045338-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES YU RUEY J (US) 2003-06-05 WO claimed
US-6824786-B2 TOPICAL APPLYING COSMETIC YU RUEY J (US) 2004-11-30 US disclosed
EP-1455734-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES Yu, Ruey J., Dr. (US) 2004-09-15 EP disclosed
US-20030108496-A1 Compositions comprising phenyl-glycine derivatives YU RUEY J (US) 2003-06-12 US disclosed
WO-2003045338-A1 COMPOSITIONS COMPRISING PHENYL-GLYCINE DERIVATIVES YU RUEY J (US) 2003-06-05 WO 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-20030108496-A1 Compositions comprising phenyl-glycine derivatives GRHPR, ARL1, SUCLG1 LMNA 1347/4885ELANE 1958/4885HSD17B10 513/4885

“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.