SCHEMBL8913715

SCHEMBL8913715

CCCCCN(CCCCC)C(=O)[C@H](N)CCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.47
DPP9 Q86TI2 1/20 0.47
CCKBR P32239 3/20 0.46
S1PR2 O95136 1/20 0.46
S1PR1 P21453 1/20 0.46
S1PR3 Q99500 1/20 0.46
GRM8 O00222 1/20 0.46
GRM6 O15303 1/20 0.46
GRIN2D O15399 1/20 0.46
GRIN3B O60391 1/20 0.46
GSR P00390 1/20 0.46
CYP1A2 P05177 1/20 0.46
GRIK1 P39086 1/20 0.46
GRM5 P41594 1/20 0.46
GRIA1 P42261 1/20 0.46
GRIA2 P42262 1/20 0.46
GRIA3 P42263 1/20 0.46
SLC1A3 P43003 1/20 0.46
SLC1A2 P43004 1/20 0.46
SLC1A1 P43005 1/20 0.46

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
SCHEMBL16240308 1.00 DPP4 (0.47) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL16240309 1.00 DPP4 (0.47) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL2784601 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL7565560 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL6535151 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL7565565 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL7572689 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL7565141 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL6659268 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1
SCHEMBL7571298 0.98 S1PR2 (0.48) DPP4DPP9CCKBRS1PR2S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5602179-A ANTISPASMODIC AGENTS ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1997-02-11 US disclosed
EP-0550899-B1 Process for preparing derivatives of (R) 5-pentylamino-5-oxopentanoic acid with anticholecystokinin activity ROTTA RESEARCH LAB (IT) 1995-12-06 EP disclosed
US-5391574-A Antispasmodic agents ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1995-02-21 US disclosed
EP-0344184-B1 DERIVATIVES OF (R) 5-PENTYLAMINO-5-OXOPENTANOIC ACID WITH ANTICHOLECYSTOKININ ACTIVITY ROTTA RESEARCH LAB (IT) 1993-11-24 EP disclosed
EP-0550899-A1 Process for preparing derivatives of (R) 5-pentylamino-5-oxopentanoic acid with anticholecystokinin activity ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1993-07-14 EP disclosed
US-5130474-A For treatment of gastrointestinal disorders such as colitis, pancreatitis, antispastic agents and biliary diskinesia ROTTA RESEARCH LABORATORIUM SPA (IT) 1992-07-14 US disclosed
EP-0344184-A1 DERIVATIVES OF (R) 5-PENTYLAMINO-5-OXOPENTANOIC ACID WITH ANTICHOLECYSTOKININ ACTIVITY. ROTTA RESEARCH LAB (IT) 1989-12-06 EP disclosed
WO-1988005774-A1 DERIVATIVES OF (R) 5-PENTYLAMINO-5-OXOPENTANOIC ACID WITH ANTICHOLECYSTOKININ ACTIVITY ROTTA RESEARCH LABORATORIUM S.P.A. (IT) 1988-08-11 WO disclosed