SCHEMBL17733595

SCHEMBL17733595

CC(=O)NC1=CCC(Cl)C=C1

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.33
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 2/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
ALOX15 P16050 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NAPRT Q6XQN6 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSP90AA1 P07900 1/20 0.30
HSP90AB1 P08238 1/20 0.30

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
SCHEMBL14107546 0.80 NAMPT (0.33) NAMPTPOLBMAPTHSD17B10GAA
SCHEMBL17733614 0.80 L3MBTL1 (0.33) NAMPTPOLBMAPTHSD17B10GAA
SCHEMBL23747568 0.75 NAMPT (0.30) NAMPT
SCHEMBL19983385 0.69 NAMPT (0.32) NAMPT
SCHEMBL24302594 0.68 SMN1; SMN2 (0.33) NAMPTMAPTHSD17B10GAAPKM
SCHEMBL23640361 0.68 SMN1; SMN2 (0.33) NAMPTMAPTHSD17B10GAAPKM
SCHEMBL7874522 0.67 HSP90AA1 (0.33) NAMPTGAAHSP90AA1HSP90AB1
SCHEMBL5960697 0.66 SMN1; SMN2 (0.34) NAMPTPOLBMAPTHSD17B10GAA
SCHEMBL17733547 0.66 NAMPT (0.33) NAMPTMAPTHSD17B10GAAPKM
SCHEMBL13591827 0.64 HSP90AA1 (0.33) NAMPTHSD17B10GAAPKMALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1696912-B1 PYRAZOLOPYRIDINES AND ANALOGS THEREOF 3M INNOVATIVE PROPERTIES CO (US) 2016-05-11 EP disclosed