SCHEMBL5364845

SCHEMBL5364845

COC(=O)C(Cc1ccccc1)NC(=O)COc1ccc(C[C@H](OC)C(=O)O)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.71
ALDH1A1 P00352 1/20 0.71
LMNA P02545 1/20 0.71
KMT2A Q03164 1/20 0.71
PPARG P37231 4/20 0.59
PPARD Q03181 3/20 0.59
PPARA Q07869 3/20 0.59
GPR34 Q9UPC5 8/20 0.58
GAA P10253 1/20 0.56
RAB9A P51151 1/20 0.56
HDAC3 O15379 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC1 Q13547 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52

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
SCHEMBL14501890 1.00 MEN1 (0.71) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL3968494 0.83 ALDH1A1 (0.60) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL5358355 0.83 ALDH1A1 (0.60) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL3960715 0.83 ALDH1A1 (0.60) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL3968491 0.83 ALDH1A1 (0.60) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL3960707 0.83 ALDH1A1 (0.60) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL3962977 0.82 ALDH1A1 (0.60) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL3962980 0.82 ALDH1A1 (0.60) MEN1ALDH1A1LMNAKMT2APPARG
SCHEMBL6148812 0.81 PTPN1 (0.68) ALDH1A1KMT2APPARGPPARDPPARA
SCHEMBL314002 0.80 MEN1 (0.65) MEN1ALDH1A1LMNAKMT2APPARG

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-7220880-B2 Amide linker peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2007-05-22 US disclosed
US-20060111406-A1 Amide linker peroxisome proliferator activated receptor modulators ELI LILLY AND COMPANY (US) 2006-05-25 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-20060111406-A1 Amide linker peroxisome proliferator activated receptor modulators PPARG, PPARA, PPARD MEN1 4823/4885ALDH1A1 840/4885LMNA 2523/4885

“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.