SCHEMBL951010

SCHEMBL951010

COC(=O)Cc1c[nH]nc1C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.41
FGFR1 P11362 1/20 0.41
PDGFRA P16234 1/20 0.41
FLT1 P17948 1/20 0.41
FGFR3 P22607 1/20 0.41
KDR P35968 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4C Q9H3R0 1/20 0.39
KDM4E B2RXH2 2/20 0.38
STAT3 P40763 1/20 0.38
HIF1A Q16665 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
MAPT P10636 2/20 0.37
HSP90AB1 P08238 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.36
MAPK1 P28482 1/20 0.35
CYP4F2 P78329 1/20 0.35
CYP4A11 Q02928 1/20 0.35
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35

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
SCHEMBL7451996 0.81 KDM4E (0.42) NPSR1KDM4CKDM4ESTAT3HIF1A
SCHEMBL22290228 0.81 NPSR1 (0.42) NPSR1KDM4CKDM4ESTAT3HIF1A
SCHEMBL948972 0.78 KDM4C (0.41) NPSR1KDM4CKDM4ESTAT3HIF1A
SCHEMBL16598697 0.76 NPSR1 (0.37) NPSR1KDM4CKDM4ESTAT3HIF1A
SCHEMBL29262474 0.74 KDM4C (0.38) NPSR1KDM4CKDM4ESTAT3HIF1A
SCHEMBL8488117 0.73 HSP90AB1 (0.47) PDGFRBFGFR1PDGFRAFLT1FGFR3
SCHEMBL22290167 0.72 NPSR1 (0.44) NPSR1KDM4ESMN1; SMN2MAPTL3MBTL1
SCHEMBL69295 0.72 NPSR1 (0.48) NPSR1KDM4CKDM4ESTAT3HIF1A
SCHEMBL5761874 0.72 NPSR1 (0.48) KDRNPSR1KDM4CKDM4ESTAT3
SCHEMBL19763311 0.72 KDM4C (0.48) NPSR1KDM4CKDM4ESTAT3HIF1A

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-2451450-B1 Inhibitors of proline racemase enzymes for the treatment of Trypanosoma spp infections PASTEUR INSTITUT (FR) 2014-07-02 EP disclosed
EP-2451450-A1 NEW INHIBITORS OF PROLINE RACEMASE ENZYMES Institut Pasteur (FR) 2012-05-16 EP disclosed
WO-2011004323-A1 NEW INHIBITORS OF PROLINE RACEMASE ENZYMES INSTITUT PASTEUR (FR) 2011-01-13 WO disclosed
EP-2272510-A1 Inhibitors of the proline racemase of trypanosoma cruzi Institut Pasteur (FR) 2011-01-12 EP disclosed