SCHEMBL22563974

SCHEMBL22563974

Cc1cccc(C(=O)NBr)c1COc1ccn(S)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 1/20 0.38
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
NOTUM Q6P988 1/20 0.32
SLC22A12 Q96S37 1/20 0.32
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
HSD17B10 Q99714 2/20 0.32
LMNA P02545 1/20 0.32
TP53 P04637 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
NR1H4 Q96RI1 1/20 0.32
PTGDR2 Q9Y5Y4 2/20 0.32
FFAR1 O14842 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
SCHEMBL22564179 0.91 HDAC3 (0.40) SGMS2POLBMEN1KMT2AHDAC3
SCHEMBL22563950 0.90 SGMS2 (0.38) SGMS2POLBMEN1KMT2AHDAC3
SCHEMBL22564022 0.88 SLC22A12 (0.36) SGMS2NOTUMSLC22A12RAB9AHSD17B10
SCHEMBL22564173 0.87 LMNA (0.34) SGMS2NPC1RAB9ALMNATP53
SCHEMBL22564164 0.87 ALDH1A1 (0.33) MEN1KMT2ANPC1RAB9ATSHR
SCHEMBL18504567 0.87 SGMS2 (0.39) SGMS2POLBMEN1KMT2AHDAC3
SCHEMBL22563856 0.87 ALDH1A1 (0.39) SGMS2POLBKMT2ARAB9ALMNA
SCHEMBL22563910 0.87 KDM4E (0.38) SGMS2MEN1KMT2ASLC22A12HSD17B10
SCHEMBL22564147 0.86 NR1H4 (0.31) NR1H4
SCHEMBL22564525 0.86 SGMS2 (0.38) SGMS2POLBMEN1KMT2AHDAC3

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