SCHEMBL1844641

SCHEMBL1844641

Cc1cc(Br)cc(C(F)(C(F)(F)F)C(F)(F)F)c1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
NOTUM Q6P988 1/20 0.33

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
SCHEMBL1842024 0.84 PGK1 (0.41) PGK1PGK2ALDH1A1NOTUM
SCHEMBL20868551 0.84 PGK1 (0.46) PGK1PGK2ALDH1A1NOTUM
SCHEMBL31026307 0.82 NOTUM (0.47) PGK1PGK2ALDH1A1MAPK1NOTUM
SCHEMBL2806676 0.82 NOTUM (0.47) PGK1PGK2ALDH1A1MAPK1NOTUM
SCHEMBL15459376 0.78 HSD11B1 (0.39) PGK1PGK2NOTUM
SCHEMBL1845896 0.77 NOTUM (0.43) NOTUM
SCHEMBL18191156 0.77 RAPGEF4 (0.47) PGK1PGK2NOTUM
SCHEMBL19240451 0.75 TSHR (0.34) ALDH1A1
SCHEMBL2745570 0.75 POLB (0.41) PGK1PGK2ALDH1A1MAPK1
SCHEMBL34460149 0.75 POLB (0.41) PGK1PGK2ALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2325165-A1 AMIDE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE AMIDE DERIVATIVE AND PEST CONTROLLING METHOD Mitsui Chemicals Agro, Inc. (JP) 2011-05-25 EP disclosed