SCHEMBL14174437

SCHEMBL14174437

CC(C)(NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CMA1 P23946 3/20 0.48
▸ ACE P12821 2/20 0.47
▸ CTRB1 P17538 1/20 0.47
▸ BCHE P06276 2/20 0.44
▸ ACHE P22303 2/20 0.44
▸ CACNA1F O60840 1/20 0.44
▸ CACNA1D Q01668 1/20 0.44
▸ CACNA1S Q13698 1/20 0.44
▸ CACNA1C Q13936 1/20 0.44
▸ FAP Q12884 1/20 0.44
▸ PREP P48147 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ REN P00797 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ FKBP1A P62942 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ KMT2A Q03164 1/20 0.42

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
SCHEMBL8422163 0.86 CTRB1 (0.53) CMA1ACECTRB1PREPTSHR
SCHEMBL17002153 0.86 CTRB1 (0.53) CMA1ACECTRB1PREPTSHR
SCHEMBL8230006 0.82 ACE (0.49) CMA1ACECTRB1FAPTSHR
SCHEMBL14174439 0.82 PREP (0.52) CMA1ACECTRB1BCHEACHE
SCHEMBL8230010 0.80 CTRB1 (0.45) CMA1ACECTRB1BCHEACHE
SCHEMBL8255877 0.79 FKBP1A (0.53) ACEPREPTSHRALDH1A1CYP3A4
SCHEMBL11598414 0.79 CTRB1 (0.51) CMA1ACECTRB1TSHRNPSR1
SCHEMBL3470628 0.78 FKBP1A (0.54) ACETSHRALDH1A1CYP3A4FKBP1A
SCHEMBL13928436 0.77 FKBP1A (0.50) ACEPREPTSHRALDH1A1CYP3A4
SCHEMBL2082078 0.76 PREP (0.56) CMA1ACECTRB1FAPPREP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080145335-A1 Analogs of Glycyl-Prolyl-Glutamate NEUREN PHARMACEUTICALS LIMITED (NZ) 2008-06-19 — — 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-20080145335-A1 Analogs of Glycyl-Prolyl-Glutamate GLS, GLUL, HIF1A CMA1 3746/4885ACE 2424/4885CTRB1 4500/4885

“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.

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