SCHEMBL2082597

SCHEMBL2082597

O=C(NCC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PREP P48147 2/20 0.69
FKBP1A P62942 10/20 0.64
ACE P12821 4/20 0.54
ALDH1A1 P00352 2/20 0.53
CYP3A4 P08684 1/20 0.51
TSHR P16473 1/20 0.51
KMT2A Q03164 1/20 0.50

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
SCHEMBL9464405 0.93 PREP (0.67) PREPFKBP1AACEALDH1A1CYP3A4
SCHEMBL18620837 0.93 PREP (0.67) PREPFKBP1AACEALDH1A1CYP3A4
SCHEMBL2228388 0.92 PREP (0.71) PREPFKBP1AACEALDH1A1KMT2A
SCHEMBL11764594 0.92 PREP (0.71) PREPFKBP1AACEALDH1A1KMT2A
SCHEMBL1189713 0.90 FKBP1A (0.63) PREPFKBP1AACEALDH1A1CYP3A4
SCHEMBL11033242 0.90 PREP (0.68) PREPFKBP1AACEALDH1A1CYP3A4
SCHEMBL9518270 0.90 PREP (0.68) PREPFKBP1AACEALDH1A1CYP3A4
SCHEMBL1997241 0.89 FKBP1A (0.64) PREPFKBP1AACE
SCHEMBL6787227 0.89 FKBP1A (0.64) PREPFKBP1AACE
SCHEMBL1997238 0.89 FKBP1A (0.64) PREPFKBP1AACE

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-113929736-B Gly-Pro-Arg-Pro-oxaminocarbonyl warfarin, synthesis, activity and application thereof 首都医科大学 2024-01-26 CN disclosed
CN-113929739-B Gly-Pro-Arg-Pro-NH ethoxycarbonyl warfarin, synthesis, activity and application thereof 首都医科大学 2023-07-28 CN disclosed
US-7863304-B2 Analogs of glycyl-prolyl-glutamate NEUREN PHARMACEUTICALS LIMITED (NZ) 2011-01-04 US disclosed
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 PREP 24/4885FKBP1A 524/4885ACE 2424/4885

“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.