SCHEMBL6669714

SCHEMBL6669714

COC(=O)C(Br)CBr.COCC(Br)C(=O)OC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.44
TSHR P16473 3/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.33
CYP2C19 P33261 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
NPC1 O15118 1/20 0.30
THRB P10828 1/20 0.30
RAB9A P51151 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
SCHEMBL15670391 0.91
SCHEMBL2318914 0.91
SCHEMBL20612847 0.89
SCHEMBL296242 0.89
SCHEMBL30412316 0.89
SCHEMBL6668169 0.83 ZDHHC7 (0.44) ZDHHC7TSHRALDH1A1SMN1; SMN2CA1
SCHEMBL6668173 0.76 ZDHHC7 (0.35) ZDHHC7
SCHEMBL2322787 0.74 ALDH1A1 (0.40) ZDHHC7TSHRALDH1A1L3MBTL1
SCHEMBL29479359 0.74 ZDHHC7 (0.57) ZDHHC7TSHRALDH1A1SMN1; SMN2CA1
SCHEMBL528250 0.74 ZDHHC7 (0.47) ZDHHC7TSHRALDH1A1SMN1; SMN2CA1

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-1456174-A1 PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES Syngenta Limited (GB) 2004-09-15 EP disclosed
WO-2003048128-A1 PYRIDYLOXYALKANOIC ACID AMIDE DERIVATIVES USEFUL AS FUNGICIDES SYNGENTA LIMITED (GB) 2003-06-12 WO disclosed