SCHEMBL22563984

SCHEMBL22563984

CCOC(=O)c1cccc(OC(F)F)c1COc1ccn(S)n1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
TSHR P16473 1/20 0.36
JMJD6 Q6NYC1 1/20 0.36
ALDH1A1 P00352 4/20 0.36
LMNA P02545 6/20 0.35
HCRTR1 O43613 2/20 0.34
HCRTR2 O43614 2/20 0.34
GABRA5 P31644 1/20 0.34
POLB P06746 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
PKM P14618 1/20 0.34
HSD17B10 Q99714 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
SCHEMBL22564039 0.92 ALDH1A1 (0.39) TBXAS1SMN1; SMN2TSHRJMJD6ALDH1A1
SCHEMBL22564303 0.91 MAPT (0.40) TBXAS1SMN1; SMN2TSHRJMJD6ALDH1A1
SCHEMBL22563951 0.90 KLKB1 (0.36) SMN1; SMN2ALDH1A1LMNAKDM4EMAPT
SCHEMBL18504422 0.89 TBXAS1 (0.38) TBXAS1SMN1; SMN2TSHRJMJD6ALDH1A1
SCHEMBL22564213 0.89 TSHR (0.40) TBXAS1SMN1; SMN2TSHRJMJD6ALDH1A1
SCHEMBL22564217 0.88 LMNA (0.35) SMN1; SMN2TSHRJMJD6ALDH1A1LMNA
SCHEMBL22564497 0.88 TBXAS1 (0.39) TBXAS1SMN1; SMN2TSHRJMJD6ALDH1A1
SCHEMBL22564215 0.88 MAPT (0.41) TBXAS1TSHRLMNAPOLBKDM4E
SCHEMBL22563858 0.86 TAS2R14 (0.35) SMN1; SMN2ALDH1A1LMNAHCRTR1HCRTR2
SCHEMBL22563857 0.86 TSHR (0.38) TBXAS1SMN1; SMN2TSHRJMJD6ALDH1A1

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-2841429-B1 TETRAZOLINONE COMPOUNDS AND ITS USE AS PESTICIDES SUMITOMO CHEMICAL CO (JP) 2020-10-21 EP disclosed