SCHEMBL8523938

SCHEMBL8523938

CCOC(=O)c1noc(C2CC2)c1C(=O)c1ccccc1-n1cncn1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 7/20 0.41
HCRTR1 O43613 3/20 0.39
HTT P42858 2/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GABRG2 P18507 6/20 0.36
GABRB3 P28472 6/20 0.36
GABRA5 P31644 6/20 0.36
MGLL Q99685 1/20 0.35
GABRA1 P14867 1/20 0.34
GABRA3 P34903 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL8490604 0.90 GABRG2 (0.36) HCRTR2HCRTR1HTTHSP90AA1MAPT
SCHEMBL8525103 0.87 GABRG2 (0.35) HCRTR2HCRTR1HTTHSP90AA1MAPT
SCHEMBL8491729 0.86 L3MBTL1 (0.35) HCRTR2HCRTR1HTTHSP90AA1MAPT
SCHEMBL8524136 0.86 GABRG2 (0.34) HCRTR2HTTHSP90AA1MAPTSMN1; SMN2
SCHEMBL8524397 0.86 CYP1A2 (0.35) HCRTR2HTTHSP90AA1MAPTSMN1; SMN2
SCHEMBL8490765 0.86 L3MBTL1 (0.35) HCRTR2HCRTR1HTTHSP90AA1MAPT
SCHEMBL8524250 0.86 LMNA (0.37) HCRTR2HCRTR1MAPT
SCHEMBL8524113 0.85 PDE4D (0.35) HCRTR2HCRTR1HTTHSP90AA1MAPT
SCHEMBL8492298 0.85 L3MBTL1 (0.34) HCRTR2HTTHSP90AA1MAPTSMN1; SMN2
SCHEMBL8524139 0.84 SMN1; SMN2 (0.41) HCRTR2HTTHSP90AA1MAPTSMN1; SMN2

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
WO-1999003856-A1 4-BENZOYL-ISOXAZOLE- AND -PYRAZOLE DERIVATIVES AND 2-CYANO 1,3-DIONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LIMITED (GB) 1999-01-28 WO disclosed