SCHEMBL6975405

SCHEMBL6975405

CCOC(=O)[C@H](CNC(=O)CNC(=O)C(CCC1CCN(C(=O)O)CC1)CCC1CCN(C(=O)OC(C)(C)C)CC1)NS(=O)(=O)CCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.45
STS P08842 1/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
YAP1 P46937 3/20 0.39
BCHE P06276 2/20 0.39
ACHE P22303 2/20 0.39
LMNA P02545 4/20 0.38
TP53 P04637 3/20 0.38
MAPT P10636 3/20 0.38
TGFBR1 P36897 1/20 0.38
THRB P10828 2/20 0.38
POLB P06746 1/20 0.37
F2 P00734 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
SCHEMBL6963135 0.94 STS (0.48) GPR119STSKDM4EPKMYAP1
SCHEMBL7951214 0.89 TGFBR1 (0.44) GPR119KDM4EPKMTGFBR1
SCHEMBL7955983 0.89 YAP1 (0.42) GPR119STSKDM4EPKMYAP1
SCHEMBL6964219 0.89 ITGB3 (0.43) GPR119KDM4EPKMLMNATHRB
SCHEMBL6968735 0.88 ITGB3 (0.45) GPR119KDM4EPKMTGFBR1
SCHEMBL6962633 0.88 MMP13 (0.49) GPR119KDM4EPKMTGFBR1
SCHEMBL6969634 0.87 ITGB3 (0.37) GPR119KDM4EPKMLMNATHRB
SCHEMBL6963440 0.86 CYP3A4 (0.41) GPR119KDM4EPKMTGFBR1
SCHEMBL7955628 0.86 ALDH1A1 (0.42) GPR119STSKDM4EPKMYAP1
SCHEMBL6970413 0.86 BCHE (0.47) GPR119KDM4EPKMYAP1BCHE

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 2 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