SCHEMBL18504446

SCHEMBL18504446

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

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.35
IRAK4 Q9NWZ3 1/20 0.34
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
TBXAS1 P24557 1/20 0.34
HTT P42858 3/20 0.33
PARP1 P09874 1/20 0.33
JAK3 P52333 1/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
LMNA P02545 4/20 0.32
MAPT P10636 2/20 0.32
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
KLKB1 P03952 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL18504924 0.90 TAS2R14 (0.36) KMT2AMEN1HTTSMN1; SMN2LMNA
SCHEMBL18504775 0.89 IRAK4 (0.48) IRAK4KMT2AMEN1TBXAS1HTT
SCHEMBL18504995 0.89 KLKB1 (0.34) HTTSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL18504984 0.89 SMN1; SMN2 (0.34) HTTSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL22564535 0.88 ROCK2 (0.34) ROCK2IRAK4KMT2AMEN1TBXAS1
SCHEMBL18504241 0.87 KLKB1 (0.36) KMT2AMEN1HTTSMN1; SMN2LMNA
SCHEMBL18504470 0.87 SMN1; SMN2 (0.35) KMT2AMEN1HTTSMN1; SMN2LMNA
SCHEMBL18504392 0.86 KMT2A (0.35) KMT2AMEN1TBXAS1HTTPARP1
SCHEMBL18504636 0.86 SMN1; SMN2 (0.37) HTTSMN1; SMN2LMNAMAPTALDH1A1
SCHEMBL18504422 0.85 TBXAS1 (0.38) TBXAS1HTTSMN1; SMN2LMNAMAPT

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
US-9565856-B2 Tetrazolinone compounds and its use as pesticides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-02-14 US disclosed