SCHEMBL8697982

SCHEMBL8697982

CC(CNO)C(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.49
ADRA2A P08913 1/20 0.49
ADRA2B P18089 1/20 0.49
HTR2A P28223 1/20 0.49
HRH1 P35367 1/20 0.49
KCNH2 Q12809 1/20 0.49
KMT2A Q03164 3/20 0.47
LMNA P02545 6/20 0.46
ALDH1A1 P00352 3/20 0.46
TSHR P16473 2/20 0.45
MDM2 Q00987 1/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
MAPT P10636 3/20 0.43
CES1 P23141 2/20 0.43
MAPK1 P28482 2/20 0.43
ALOX15 P16050 2/20 0.43
HPGD P15428 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL29016421 0.83 KMT2A (0.50) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL19305014 0.79 PGR (0.47) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL8697183 0.78 MMP2 (0.49) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL10489465 0.78 PGR (0.58) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL14665678 0.78 PGR (0.53) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL337276 0.78 L3MBTL1 (0.54) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL2736656 0.78 L3MBTL1 (0.54) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL2736655 0.78 L3MBTL1 (0.54) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL2128162 0.78 PGR (0.58) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL9324510 0.78 KMT2A (0.45) PGRADRA2AADRA2BHTR2AHRH1

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
WO-1998003478-A1 NITRONE DERIVATIVES, PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION, AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1998-01-29 WO disclosed
WO-1998003479-A1 NITRONE DERIVATIVES, PROCESSES AND INTERMEDIATES FOR THEIR PREPARATION, AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1998-01-29 WO disclosed