SCHEMBL2016908

SCHEMBL2016908

CC1(C)OC(C)(C)C(=Cc2c(C3CC3)ccc(-c3ccc(Cl)cc3)c2F)C1=O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.30
GAA P10253 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 1/20 0.30
PLEC Q15149 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL867678 0.78 GPBAR1 (0.33)
SCHEMBL867677 0.78 GPBAR1 (0.33)
SCHEMBL10121145 0.78 GPBAR1 (0.33)
SCHEMBL868557 0.76 EDNRB (0.34) MAPT
SCHEMBL868556 0.76 EDNRB (0.34) MAPT
SCHEMBL10121167 0.76 EDNRB (0.34) MAPT
SCHEMBL17891122 0.76 ALOX5AP (0.31)
SCHEMBL28340174 0.71 ALOX5AP (0.31)
SCHEMBL28337831 0.71 SLC6A3 (0.38) MEN1KMT2A
SCHEMBL25440018 0.70 CNR1 (0.31)

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
EP-2523555-A2 HERBICIDAL COMPOSITIONS COMPRISING, AND METHODS OF USE OF, HERBICIDALLY ACTIVE PYRANDIONES Syngenta Limited (GB) 2012-11-21 EP disclosed
WO-2011073616-A2 HERBICIDAL COMPOSITIONS COMPRISING, AND METHODS OF USE OF, HERBICIDALLY ACTIVE PYRANDIONES SYNGENTA LIMITED (GB) 2011-06-23 WO disclosed