SCHEMBL4675017

SCHEMBL4675017

CC(Nc1c(-c2c(F)cc(F)cc2F)cnc2ncnn12)C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.32
MAPK1 P28482 1/20 0.32
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL974956 0.81 MAPK1 (0.41) MAPK1
SCHEMBL343322 0.80 MAPK1 (0.35) MAPK1KDM4EALDH1A1
SCHEMBL4818612 0.80 MAPK1 (0.35) MAPK1KDM4EALDH1A1
SCHEMBL4484955 0.80 MAPK1 (0.35) MAPK1KDM4EALDH1A1
SCHEMBL13266845 0.80 MAPK1 (0.35) MAPK1KDM4EALDH1A1
SCHEMBL976390 0.80 MAPK1 (0.35) MAPK1KDM4EALDH1A1
SCHEMBL14596578 0.77 KMT2A (0.37) MAPK1KDM4EALDH1A1
SCHEMBL14370113 0.77 MAPK1 (0.34) MAPK1KDM4EALDH1A1
SCHEMBL4820252 0.74 MAPK1 (0.40) ABL1MAPK1KDM4EALDH1A1
SCHEMBL4488801 0.74 MAPK1 (0.40) ABL1MAPK1KDM4EALDH1A1

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-1889028-A1 METHOD FOR DETERMINING PESTICIDE RESIDUES IN SOIL OR PLANT MATERIAL BASF AKTIENGESELLSCHAFT (DE) 2008-02-20 EP disclosed
WO-2006125644-A1 METHOD FOR DETERMINING PESTICIDE RESIDUES IN SOIL OR PLANT MATERIAL BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 WO disclosed