Fluroxypyr

Fluroxypyr

SCHEMBL21173647

Nc1c(Cl)c(F)nc(OCC(=O)O)c1Cl.O=C(O)COc1ccc(Cl)cc1Cl

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.61
TSHR P16473 1/20 0.56
MAPT P10636 1/20 0.45
RECQL P46063 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PPARD Q03181 1/20 0.43
PTGDR2 Q9Y5Y4 5/20 0.43
CYP2C19 P33261 1/20 0.43
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ALOX12 P18054 1/20 0.43
KMT2A Q03164 1/20 0.43
MRGPRX4 Q96LA9 2/20 0.42
RAB9A P51151 1/20 0.42

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
Fluroxypyr SCHEMBL29396793 0.84 TDP1 (0.35) TDP1TSHRSMN1; SMN2PTGDR2ALDH1A1
Fluroxypyr SCHEMBL5158164 0.84 TDP1 (0.35) TDP1TSHRSMN1; SMN2PTGDR2ALDH1A1
Fluroxypyr SCHEMBL23545 0.84 TDP1 (0.35) TDP1TSHRSMN1; SMN2PTGDR2ALDH1A1
Fluroxypyr SCHEMBL21112037 0.83 TDP1 (0.34) TDP1TSHRSMN1; SMN2PTGDR2ALDH1A1
Fluroxypyr SCHEMBL22041988 0.83 TDP1 (0.34) TDP1TSHRSMN1; SMN2PTGDR2ALDH1A1
Fluroxypyr SCHEMBL22163789 0.83 TDP1 (0.34) TDP1TSHRSMN1; SMN2PTGDR2ALDH1A1
Fluroxypyr SCHEMBL30612286 0.83 TDP1 (0.34) TDP1TSHRSMN1; SMN2PTGDR2ALDH1A1
Fluroxypyr SCHEMBL28803956 0.80 IAPP (0.34) TDP1TSHRMAPTSMN1; SMN2PTGDR2
Fluroxypyr SCHEMBL28104827 0.80 MAPT (0.33) TDP1TSHRMAPTRECQLMEN1
Fluroxypyr SCHEMBL8557509 0.80 KDM4E (0.34) TDP1TSHRMAPTPTGDR2ALDH1A1

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-3207800-B1 HERBICIDE COMBINATION UPL EUROPE LTD (GB) 2019-07-24 EP disclosed