SCHEMBL5178489

SCHEMBL5178489

CC(=O)OCC[C@H](NC(=O)OCc1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.55
ALOX15 P16050 1/20 0.54
CTSL P07711 4/20 0.54
CTSK P43235 4/20 0.53
SIRT2 Q8IXJ6 1/20 0.53
SIRT1 Q96EB6 1/20 0.53
CTSS P25774 3/20 0.52
CTSB P07858 1/20 0.52
ITGB3 P05106 5/20 0.51
ITGA2B P08514 5/20 0.51
PPARG P37231 1/20 0.51
PPARA Q07869 1/20 0.51
KYNU Q16719 1/20 0.50
TACR1 P25103 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
SCHEMBL8436190 0.91 SIRT2 (0.58) ALDH1A1ALOX15CTSLCTSKSIRT2
SCHEMBL8436193 0.91 SIRT2 (0.58) ALDH1A1ALOX15CTSLCTSKSIRT2
SCHEMBL22637150 0.88 KYNU (0.57) ALDH1A1ALOX15CTSLCTSKSIRT2
SCHEMBL29262797 0.88 KYNU (0.57) ALDH1A1ALOX15CTSLCTSKSIRT2
SCHEMBL14673025 0.86 ALDH1A1 (0.58) ALDH1A1ALOX15CTSLCTSKCTSS
SCHEMBL14673026 0.86 ALDH1A1 (0.58) ALDH1A1ALOX15CTSLCTSKCTSS
SCHEMBL27626645 0.85 FOLH1 (0.57) ALDH1A1ALOX15CTSLCTSKSIRT2
SCHEMBL116479 0.85 FOLH1 (0.57) ALDH1A1ALOX15CTSLCTSKSIRT2
SCHEMBL329038 0.85 CTSK (0.66) ALDH1A1ALOX15CTSLCTSKSIRT2
SCHEMBL265783 0.85 CTSK (0.66) ALDH1A1ALOX15CTSLCTSKSIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0959070-B1 Process for the production of 3-amino-2-oxopyrrolidines, novel intermediates and their use DEGUSSA (DE) 2007-09-12 EP disclosed
US-6492541-B2 Process for the preparation of 3-amino-2-oxo-pyrrolidines, novel intermediates and their use DEGUSSA-HULS AKTIENGESELLSCHAFT (DE) 2002-12-10 US disclosed
US-20020045763-A1 Process for the preparation of 3-amino-2-oxo-pyrrolidines, novel intermediates and their use DEGUSSA-HULS AKTIENGENSELLSCHAFT 2002-04-18 US disclosed
US-20010025109-A1 Process for the preparation of 3-amino-2-oxo-pyrrolidines, novel intermediates and their use DEGUSSA-HULS AKTIENGENSELLSCHAFT 2001-09-27 US disclosed
US-6281364-B1 CYCLIZATION DEGUSSA-HULS AG (DE) 2001-08-28 US disclosed
EP-0959070-A1 Process for the production of 3-amino-2-oxopyrrolidines, novel intermediates and their use Degussa-Hüls Aktiengesellschaft (DE) 1999-11-24 EP 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 (2 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-20010025109-A1 Process for the preparation of 3-amino-2-oxo-pyrrolidines, novel intermediates and their use AAAS, IL4I1, PGLS ALDH1A1 2647/4885ALOX15 3626/4885CTSL 891/4885
US-20020045763-A1 Process for the preparation of 3-amino-2-oxo-pyrrolidines, novel intermediates and their use AAAS, IL4I1, PGLS ALDH1A1 2647/4885ALOX15 3626/4885CTSL 891/4885

“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.