SCHEMBL18504566

SCHEMBL18504566

NC(=O)c1cccc(SC(F)(F)F)c1COc1ccn(O)n1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 6/20 0.34
FFAR1 O14842 3/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TBXAS1 P24557 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
PARP1 P09874 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
SCHEMBL18504920 0.90 FFAR4 (0.37) FFAR4FFAR1HCRTR1HCRTR2
SCHEMBL18504396 0.89 FFAR4 (0.34) FFAR4FFAR1HCRTR1HCRTR2
SCHEMBL18505002 0.89 FFAR4 (0.34) FFAR4FFAR1HCRTR1HCRTR2
SCHEMBL22564384 0.88 FFAR4 (0.33) FFAR4FFAR1KDM4EALDH1A1SMN1; SMN2
SCHEMBL18500400 0.87 POLB (0.37) FFAR4KDM4EALDH1A1SMN1; SMN2HCRTR1
SCHEMBL18504754 0.87 FFAR4 (0.33) FFAR4FFAR1KDM4E
SCHEMBL18504863 0.87 RXFP1 (0.33) FFAR4FFAR1
SCHEMBL18504643 0.86 FFAR4 (0.32) FFAR4FFAR1
SCHEMBL18504786 0.86 PARP1 (0.30) PARP1
SCHEMBL18504660 0.85 TSHR (0.36) KDM4EALDH1A1TBXAS1HCRTR1HCRTR2

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-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed
US-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 US disclosed