SCHEMBL7360733

SCHEMBL7360733

CCN(C(=O)CN)[C@H]([C]=O)CC(=O)O

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.31
LMNA P02545 1/20 0.31
CACNA2D1 P54289 2/20 0.31
CACNB3 P54284 1/20 0.31
CACNA1C Q13936 1/20 0.31
PGR P06401 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR2B P41595 1/20 0.31
CACNA2D2 Q9NY47 1/20 0.31
GLRA1 P23415 1/20 0.30
SLC6A9 P48067 1/20 0.30
OR51E2 Q9H255 1/20 0.30

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
SCHEMBL7742963 0.84
SCHEMBL2183501 0.77 CPB2 (0.36)
SCHEMBL7748340 0.74 GAA (0.30)
SCHEMBL24671536 0.69 MEN1 (0.33) GABRR1LMNA
SCHEMBL28712419 0.67 GABRR1 (0.34) GABRR1LMNA
SCHEMBL3061108 0.64 SLC22A6 (0.32)
Hydrochloric Acid SCHEMBL19182723 0.63
SCHEMBL7749782 0.61 GAA (0.34)
SCHEMBL27623511 0.61 S1PR2 (0.33) GABRR1LMNACACNA2D1CACNB3CACNA1C
SCHEMBL1790227 0.58

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0812205-A4 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE POULENC RORER PHARMA (US) 1999-03-31 EP disclosed
EP-0812205-A1 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-12-17 EP disclosed
WO-1995010295-A1 ANTITHROMBOTIC AZACYCLOALKYLALKANOYL PEPTIDES AND PSEUDOPEPTIDES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-04-20 WO disclosed