SCHEMBL8811646

SCHEMBL8811646

CC(O)CCOc1cccc(C(F)(F)F)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.60
▸ ALDH1A1 P00352 2/20 0.60
▸ GAA P10253 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ PTGES O14684 1/20 0.49
▸ ALOX5 P09917 1/20 0.49
▸ PPARG P37231 1/20 0.49
▸ PPARA Q07869 1/20 0.49
▸ MAOB P27338 2/20 0.48
▸ AOC3 Q16853 1/20 0.48
▸ MRGPRX4 Q96LA9 1/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ HTT P42858 1/20 0.45

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
SCHEMBL19750630 0.84 KDM4E (0.56) KDM4EALDH1A1GAAL3MBTL1MAOB
SCHEMBL4046553 0.84 KDM4E (0.56) KDM4EALDH1A1GAAL3MBTL1MAOB
SCHEMBL29847359 0.84 KDM4E (0.56) KDM4EALDH1A1GAAL3MBTL1MAOB
SCHEMBL13251247 0.83 L3MBTL1 (0.57) KDM4EALDH1A1GAAL3MBTL1PTGES
SCHEMBL2742739 0.81 CHRNB2 (0.51) ALDH1A1PPARAMAOBAOC3
SCHEMBL8509021 0.80 KDM4E (0.58) KDM4EALDH1A1GAAL3MBTL1PTGES
SCHEMBL171811 0.79 L3MBTL1 (0.68) KDM4EALDH1A1GAAL3MBTL1PTGES
SCHEMBL585718 0.79 L3MBTL1 (0.59) KDM4EALDH1A1GAAL3MBTL1MAOB
SCHEMBL6049337 0.79 L3MBTL1 (0.52) KDM4EALDH1A1GAAL3MBTL1PTGES
SCHEMBL10922975 0.78 KDM4E (0.59) KDM4EALDH1A1GAAL3MBTL1

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-0800518-A1 CARBAMATE HERBICIDES Novartis AG (CH) 1997-10-15 — — EP disclosed
WO-1996016941-A1 CARBAMATE HERBICIDES NOVARTIS AG (CH) 1996-06-06 — — WO disclosed
EP-0625139-A1 SUBSTITUTED BENZYL CARBAMATES WITH HERBICIDAL PROPERTIES. CIBA GEIGY AG (CH) 1994-11-23 — — EP disclosed
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