SCHEMBL11246266

SCHEMBL11246266

Cc1cc(C)c(C)c(-n2cc(C#N)c(=O)[nH]c2=O)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
KMT2A Q03164 4/20 0.47
MEN1 O00255 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 6/20 0.34
ALDH1A1 P00352 4/20 0.34
HPGD P15428 3/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
GALR3 O60755 1/20 0.34
MAPT P10636 1/20 0.33
CYP2C19 P33261 2/20 0.33
PDE3B Q13370 2/20 0.33
PDE3A Q14432 2/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
PDE5A O76074 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL11247752 0.84 GAA (0.52) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11250834 0.83 GAA (0.52) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11256527 0.81 GAA (0.59) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11246044 0.78 GAA (0.47) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11249755 0.78 GAA (0.47) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11247042 0.77 GAA (0.58) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11247286 0.76 KMT2A (0.51) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11251632 0.76 GAA (0.50) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11253313 0.76 GAA (0.50) GAAL3MBTL1KMT2AMEN1SMN1; SMN2
SCHEMBL11257435 0.76 GAA (0.50) GAAL3MBTL1KMT2AMEN1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4338318-A FUNGICIDE OR BACERICIDE TO TREAT PLANT DISEASES WITH A PHENYL URACIL ZOECON CORPORATION (US) 1982-07-06 US disclosed
US-4297297-A α-Cyano-β-(substituted-anilino)-N-ethoxycarbonylacrylamide intermediates ZOECON CORP. (US) 1981-10-27 US disclosed
US-4266056-A FUNGICIDES, BACTERICIDES ZOECON CORPORATION (US) 1981-05-05 US disclosed