SCHEMBL18504865

SCHEMBL18504865

O=C(NO)c1cccc(F)c1COc1ccn(O)n1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
SGMS2 Q8NHU3 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
GUCY1B2 O75343 7/20 0.34
GUCY1A2 P33402 7/20 0.34
GUCY1A1 Q02108 7/20 0.34
GUCY1B1 Q02153 7/20 0.34
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
ALKBH1 Q13686 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
PTGER1 P34995 1/20 0.33
RAB9A P51151 1/20 0.33
PDE5A O76074 1/20 0.33
LIG1 P18858 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
SCHEMBL18504744 0.91 SGMS2 (0.36) SGMS2TDP1GUCY1B2GUCY1A2GUCY1A1
SCHEMBL18504751 0.89 SGMS2 (0.37) SGMS2TDP1GUCY1B2GUCY1A2GUCY1A1
SCHEMBL22564169 0.87 HDAC1 (0.35) HDAC1HDAC6SGMS2TDP1GUCY1B2
SCHEMBL18504583 0.87 ALDH1A1 (0.33) TDP1NPC1MEN1KMT2ARAB9A
SCHEMBL18500953 0.86 ALKBH1 (0.40) SGMS2TDP1NPC1ALKBH1KMT2A
SCHEMBL18504779 0.86 PDE5A (0.32) HDAC1HDAC6LMNAPDE5ALIG1
SCHEMBL18504821 0.86 HDAC3 (0.41) HDAC1HDAC6SGMS2NPC1MEN1
SCHEMBL18504787 0.86 HDAC3 (0.41) HDAC1HDAC6SGMS2TDP1KMT2A
SCHEMBL18504646 0.86 PDE5A (0.35) HDAC1HDAC6PDE5ALIG1
SCHEMBL18504220 0.86 KMT2A (0.40) TDP1LMNAKMT2A

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