SCHEMBL2820574

SCHEMBL2820574

N[C@@H](CC(=O)O)C(=O)NCCc1c[nH]cn1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NLN Q9BYT8 3/20 0.36
LTA4H P09960 2/20 0.34
HTT P42858 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL27623099 1.00 NLN (0.36) NLNLTA4HHTTATM
SCHEMBL18381249 0.87 LTA4H (0.38) NLNLTA4H
SCHEMBL2824143 0.87 LTA4H (0.38) NLNLTA4H
SCHEMBL2930648 0.87 LTA4H (0.38) NLNLTA4H
SCHEMBL15398762 0.86 NLN (0.39) NLN
SCHEMBL7624042 0.86 NLN (0.42) NLN
SCHEMBL7624049 0.86 NLN (0.42) NLN
SCHEMBL7619939 0.85 LARS1 (0.39) HTTATM
SCHEMBL7619941 0.85 LARS1 (0.39) HTTATM
SCHEMBL15398758 0.84 DPP7 (0.44) NLN

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-1020179-B9 PEPTIDE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, METHOD FOR PRODUCING THE SAME, USE OF SAID DERIVATIVES AND PHARMACEUTICAL COMPOSITION OTKRYTOE AKTSIONERNOE OBSCHESTVO OTECHESTVENNYE LEKARSTVA (RU) 2011-02-02 EP disclosed
EP-2229935-A1 Peptide derivatives or pharmaceutically acceptable salts thereof, method for producing the same, use of said derivatives and pharmaceutical composition Nebolsin, Vladimir Evgenievich (RU) 2010-09-22 EP disclosed
EP-1020179-B1 PEPTIDE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, METHOD FOR PRODUCING THE SAME, USE OF SAID DERIVATIVES AND PHARMACEUTICAL COMPOSITION OTKRYTOE AKTSIONERNOE OBSCHEST (RU) 2009-12-09 EP disclosed
EP-1020179-A2 PEPTIDE DERIVATIVES OR PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, METHOD FOR PRODUCING THE SAME, USE OF SAID DERIVATIVES AND PHARMACEUTICAL COMPOSITION Nebolsin, Vladimir Evgenievich (RU) 2000-07-19 EP disclosed