SCHEMBL8528144

SCHEMBL8528144

CC(O)C(NC(=O)C(N)CC(N)=O)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CD274 Q9NZQ7 4/20 0.57
PDCD1LG2 Q9BQ51 2/20 0.57
VSIR Q9H7M9 3/20 0.45
MME P08473 2/20 0.44
PDCD1 Q15116 1/20 0.41
ECE1 P42892 3/20 0.40
DPP4 P27487 2/20 0.38
DPP8 Q6V1X1 2/20 0.38
DPP9 Q86TI2 2/20 0.38
CTSD P07339 1/20 0.38
BACE1 P56817 1/20 0.38
CA2 P00918 2/20 0.37
CA1 P00915 1/20 0.37

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
SCHEMBL29572257 1.00 CD274 (0.57) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL29572216 1.00 CD274 (0.57) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL5998197 1.00 CD274 (0.57) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL30123154 0.97 CD274 (0.54) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL30390006 0.94 CD274 (0.52) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL29369310 0.94 CD274 (0.52) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL30390484 0.92 CD274 (0.61) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL29697048 0.91 CD274 (0.49) CD274PDCD1LG2VSIRMMEPDCD1
SCHEMBL30390119 0.90 CD274 (0.55) CD274PDCD1LG2VSIRMMEECE1
SCHEMBL30390127 0.90 PDCD1LG2 (0.49) CD274PDCD1LG2

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
JP-57035551-A None JP disclosed
EP-0885899-A1 Method for obtaining peptide fragments by use of fluorinated organic acids SEIKO INSTRUMENTS INC. (JP) 1998-12-23 EP disclosed
US-4507230-A DETACHING RESINS FROM PEPTIDES RESEARCH CORPORATION (US) 1985-03-26 US disclosed
JP-S5735551-A PREPARATION OF UNDECAPEPTIDE DAIICHI RAJIO ISOTOPE KENKYUSHO:KK 1982-02-26 JP disclosed