SCHEMBL22564082

SCHEMBL22564082

O=C(Cl)c1cccc(F)c1COc1ccn(S)n1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.42
ALOX15 P16050 1/20 0.42
TDP1 Q9NUW8 2/20 0.38
KMT2A Q03164 3/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
SGMS2 Q8NHU3 1/20 0.34
ALKBH1 Q13686 2/20 0.34
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.32
MEN1 O00255 2/20 0.32
NPC1 O15118 1/20 0.32
ELANE P08246 1/20 0.32
PTGER1 P34995 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL22564177 0.89 ALKBH1 (0.39) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL22564128 0.88 KLKB1 (0.37) TDP1ALKBH1MAPT
SCHEMBL22564458 0.88 TDP1 (0.36) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL22564137 0.87 SGMS2 (0.37) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL18504987 0.86 ALDH1A1 (0.40) ALDH1A1ALOX15TDP1KMT2AATM
SCHEMBL22563912 0.86 NR1H4 (0.37) ALDH1A1TDP1KMT2AATML3MBTL1
SCHEMBL22564068 0.86 SGMS2 (0.35) ALDH1A1TDP1KMT2AL3MBTL1SGMS2
SCHEMBL22564084 0.86 ALDH1A1 (0.31) ALDH1A1ALOX15
SCHEMBL22564169 0.86 HDAC1 (0.35) TDP1KMT2AL3MBTL1SGMS2ALKBH1
SCHEMBL22564062 0.85 SGMS2 (0.35) L3MBTL1SGMS2NPC1RAB9A

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