SCHEMBL1069070

SCHEMBL1069070

C#CCN(C)c1c(C)cc(C)cc1OC(=O)NC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.36
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PYCR1 P32322 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 5/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ACHE P22303 5/20 0.33
BCHE P06276 1/20 0.33
PGR P06401 1/20 0.32
GAA P10253 1/20 0.32
PTGS1 P23219 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C8 P10632 1/20 0.32
CYP2B6 P20813 1/20 0.32
MMP1 P03956 1/20 0.31
MMP9 P14780 1/20 0.31
MMP13 P45452 1/20 0.31

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
SCHEMBL434594 0.83 RAF1 (0.39) KDM4EKMT2AL3MBTL1ALDH1A1ACHE
SCHEMBL3655863 0.76 ALDH1A1 (0.41) KDM4EKMT2AL3MBTL1ALDH1A1ACHE
SCHEMBL11509949 0.75 RAF1 (0.39) ALDH1A1ACHEBCHECYP1A2CYP2C8
SCHEMBL435129 0.73 ACHE (0.46) KDM4EKMT2AL3MBTL1ALDH1A1ACHE
SCHEMBL31741648 0.73 ACHE (0.46) KDM4EKMT2AL3MBTL1ALDH1A1ACHE
SCHEMBL29729485 0.72 ALDH1A1 (0.49) KDM4EKMT2AL3MBTL1NPSR1ALDH1A1
SCHEMBL4315998 0.72 ALDH1A1 (0.49) KDM4EKMT2AL3MBTL1NPSR1ALDH1A1
SCHEMBL5184928 0.70 CYP1A2 (0.44) KDM4EKMT2AALDH1A1SMN1; SMN2MAPK1
SCHEMBL11509648 0.69 ACHE (0.41) KDM4EALDH1A1SMN1; SMN2ACHEBCHE
SCHEMBL11484879 0.69 KDM4E (0.44) KDM4EKMT2AL3MBTL1ALDH1A1ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1802198-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS Syngeta Participations AG (CH) 2007-07-04 EP claimed
WO-2006037632-A1 SYNERGISTIC FUNGICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2006-04-13 WO claimed
EP-3416959-A1 PESTICIDALLY ACTIVE PYRAZOLE DERIVATIVES Syngenta Participations AG (CH) 2018-12-26 EP disclosed
WO-2017140771-A1 PESTICIDALLY ACTIVE PYRAZOLE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2017-08-24 WO disclosed
EP-2273873-A1 STABLE AQUEOUS SPORE-CONTAINING FORMULATION Bayer Cropscience LP (US) 2011-01-19 EP disclosed
WO-2009126473-A1 STABLE AQUEOUS SPORE-CONTAINING FORMULATION BAYER CROPSCIENCE LP (US) 2009-10-15 WO disclosed