SCHEMBL11271819

SCHEMBL11271819

CON(C)C(=O)Nc1ccc(Oc2cccc(C(F)(F)F)c2)nc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.67
MAPT P10636 4/20 0.67
L3MBTL1 Q9Y468 4/20 0.67
MAPK1 P28482 2/20 0.67
TDP1 Q9NUW8 1/20 0.67
RAB9A P51151 2/20 0.66
ALDH1A1 P00352 3/20 0.62
KDM4E B2RXH2 2/20 0.62
NPSR1 Q6W5P4 1/20 0.62
NPC1 O15118 2/20 0.56
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
POLB P06746 1/20 0.52
TNF P01375 1/20 0.50
NOD1 Q9Y239 1/20 0.50
RAF1 P04049 1/20 0.49
KDR P35968 3/20 0.48
MAPK14 Q16539 3/20 0.48
TNNI3K Q59H18 3/20 0.48
BRAF P15056 2/20 0.48

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
SCHEMBL11272027 0.90 GAA (0.70) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL11273389 0.86 TLR8 (0.56) MAPTTDP1RAB9AMEN1KMT2A
SCHEMBL11215474 0.81 MEN1 (0.49) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL30002112 0.81 GAA (0.78) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL11404638 0.78 GAA (0.68) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL10310308 0.78 GAA (0.67) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL14284626 0.76 GAA (0.68) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL14784814 0.76 GAA (0.74) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL11397599 0.76 GAA (0.67) GAAMAPTL3MBTL1MAPK1TDP1
SCHEMBL11390425 0.75 GAA (0.64) GAAMAPTL3MBTL1MAPK1TDP1

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
US-4334912-A HERBICIDES WHICH ARE NONPHYTOTOXIC TO CROPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-15 US claimed
US-4334912-A HERBICIDES WHICH ARE NONPHYTOTOXIC TO CROPS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-06-15 US disclosed