SCHEMBL4444071

SCHEMBL4444071

CN(C)C(=O)C[C@@H]1CCCN1C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 4/20 0.42
POLB P06746 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PREP P48147 2/20 0.36
FAP Q12884 1/20 0.35
HRH3 Q9Y5N1 2/20 0.34
KCNH2 Q12809 1/20 0.34
FFAR1 O14842 2/20 0.33
ACE P12821 2/20 0.33
REN P00797 1/20 0.33
LMNA P02545 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HCRTR2 O43614 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
SCHEMBL28245271 0.80 POLB (0.46) POLBL3MBTL1FFAR1ACEREN
SCHEMBL28245274 0.80 POLB (0.46) POLBL3MBTL1FFAR1ACEREN
SCHEMBL1777983 0.80 POLB (0.48) POLBL3MBTL1FFAR1ACEREN
SCHEMBL4066863 0.80 POLB (0.48) POLBL3MBTL1FFAR1ACEREN
SCHEMBL1777982 0.80 POLB (0.48) POLBL3MBTL1FFAR1ACEREN
SCHEMBL7454324 0.79 POLB (0.39) POLBL3MBTL1HRH3LMNA
SCHEMBL5412325 0.79 OPRK1 (0.46) DPP4POLBL3MBTL1PREPFAP
SCHEMBL5015466 0.79 CHRNB2 (0.41) DPP4
SCHEMBL3295966 0.79 OPRK1 (0.46) DPP4POLBL3MBTL1PREPFAP
SCHEMBL5412332 0.79 OPRK1 (0.46) DPP4POLBL3MBTL1PREPFAP

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-2134343-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX Pharmaceuticals, Inc. (US) 2009-12-23 EP disclosed
WO-2008124849-A2 PYRROLO-PYRIDINE KINASE MODULATORS SGX PHARMACEUTICALS, INC. (US) 2008-10-16 WO disclosed