SCHEMBL9019293

SCHEMBL9019293

N#CC(CC=O)C(=O)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.41
TDP1 Q9NUW8 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 3/20 0.39
CES1 P23141 3/20 0.39
CES2 O00748 2/20 0.39
MAPK1 P28482 3/20 0.38
ALDH1A1 P00352 2/20 0.38
ALKBH5 Q6P6C2 1/20 0.38
PGR P06401 1/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
HTR2A P28223 1/20 0.38
HRH1 P35367 1/20 0.38
KCNH2 Q12809 1/20 0.38
HPGD P15428 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
ALPG P10696 1/20 0.36
NR4A2 P43354 1/20 0.36
MAPT P10636 2/20 0.36

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
SCHEMBL11147694 0.79 ALKBH5 (0.43) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL31468333 0.79 PGR (0.47) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL7030603 0.77 MDM2 (0.59) MDM2ALDH1A1MAPTRAB9AKMT2A
SCHEMBL9019110 0.77 ALKBH5 (0.46) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL9854646 0.76 NR4A2 (0.44) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL13710706 0.74 CES1 (0.48) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL1224747 0.73 TDP1 (0.44) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL10644287 0.73 PGR (0.49) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL8575631 0.73 MDM2 (0.44) MDM2TDP1L3MBTL1LMNACES1
SCHEMBL9018972 0.72 NPC1 (0.42) MDM2TDP1L3MBTL1LMNACES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0434940-B1 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID CO (US) 1996-05-29 EP claimed
US-5399716-A N-oxygenated arylpyrrole insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1995-03-21 US claimed
EP-0434940-A2 N-oxygenated arylpyrrole, insecticidal, acaricidal and nematicidal agents AMERICAN CYANAMID COMPANY (US) 1991-07-03 EP claimed