SCHEMBL7645602

SCHEMBL7645602

CCCCCN[C@@H](CCSC)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
NOD1 Q9Y239 1/20 0.39
DPP7 Q9UHL4 2/20 0.39
FNTA P49354 3/20 0.37
FNTB P49356 3/20 0.37
PGGT1B P53609 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
RRM1 P23921 1/20 0.36
TSHR P16473 1/20 0.35
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35

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
SCHEMBL11497983 1.00 EPHX1 (0.40) EPHX1CA12CA9NOD1DPP7
SCHEMBL18737750 0.87 NOD1 (0.39) EPHX1NOD1DPP7FNTAFNTB
SCHEMBL1147839 0.85 NOD1 (0.49) CA12CA9NOD1FNTAFNTB
SCHEMBL303334 0.85 NOD1 (0.49) CA12CA9NOD1FNTAFNTB
SCHEMBL303333 0.85 NOD1 (0.49) CA12CA9NOD1FNTAFNTB
SCHEMBL25411986 0.84 NOD1 (0.51) NOD1FNTAFNTBPGGT1B
SCHEMBL5087530 0.84 NOD1 (0.51) NOD1FNTAFNTBPGGT1B
SCHEMBL7765496 0.84 NOD1 (0.51) NOD1FNTAFNTBPGGT1B
SCHEMBL9341319 0.84 NOD1 (0.51) NOD1FNTAFNTBPGGT1B
SCHEMBL462399 0.84 NOD1 (0.48) CA12CA9NOD1FNTAFNTB

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
EP-0985665-B1 Process for the preparation of 3-amino-2-oxo-pyrrolidines, intermediates and use thereof DEGUSSA (DE) 2002-12-11 EP disclosed
US-6156908-A Procedure for the manufacture of 3-amino-2-oxo-pyrrolidines, new intermediates and their use ROHM GESELLSCHAFT, GMBH (DE) 2000-12-05 US disclosed
EP-0985665-A1 Process for the preparation of 3-amino-2-oxo-pyrrolidines, intermediates and use thereof Degussa-Hüls Aktiengesellschaft (DE) 2000-03-15 EP disclosed
US-4216225-A ANTIULCER AGENTS KOWA COMPANY, LTD. (JP) 1980-08-05 US disclosed