SCHEMBL6972128

SCHEMBL6972128

CCOC(=O)[C@@H](N)CNC(=O)CCNC(=O)C(CCC1CCN(C(=O)O)CC1)CCC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.40
KDM4E B2RXH2 1/20 0.39
PKM P14618 1/20 0.39
BCHE P06276 2/20 0.35
ACHE P22303 2/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
DPP4 P27487 1/20 0.34
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL6977865 0.91 GPR119 (0.41) GPR119KDM4EPKMLMNATHRB
Hydrochloric Acid SCHEMBL7953851 0.91 GPR119 (0.40) GPR119KDM4EPKMLMNATHRB
SCHEMBL6977329 0.82 TGFBR1 (0.43) GPR119KDM4EPKMBCHEACHE
SCHEMBL6977326 0.82 TGFBR1 (0.43) GPR119KDM4EPKMBCHEACHE
SCHEMBL6973933 0.82 KDM4E (0.41) GPR119KDM4EPKMBCHEACHE
SCHEMBL6967652 0.81 BCHE (0.51) GPR119BCHEACHEMAPTNPSR1
SCHEMBL7752382 0.79 GPR119 (0.42) GPR119KDM4EPKMDPP4MAPT
SCHEMBL6973594 0.78 ITGB3 (0.44) KDM4EBCHEACHELMNA
SCHEMBL6973599 0.78 ITGB3 (0.44) KDM4EBCHEACHELMNA
SCHEMBL23849943 0.77 DPP4 (0.46) GPR119KDM4EPKMLMNADPP4

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-1098878-B1 BISPIPERIDINES AS ANTITHROMBOTIC AGENTS CEPHALON FRANCE (FR) 2003-12-17 EP disclosed
US-6333338-B1 ANTICOAGULANTS, CARDIOVASCULAR DISORDERS LABORATOIRE L. LAFON (FR) 2001-12-25 US disclosed
EP-1098878-A1 BISPIPERIDINES AS ANTITHROMBOTIC AGENTS LABORATOIRE L. LAFON (FR) 2001-05-16 EP disclosed
WO-2000003986-A1 BISPIPERIDINES AS ANTITHROMBOTIC AGENTS LABORATOIRE L. LAFON (FR) 2000-01-27 WO disclosed