SCHEMBL22563986

SCHEMBL22563986

CCSc1cccc(C(=O)NBr)c1COc1ccn(S)n1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.35
HSD17B10 Q99714 6/20 0.35
ALDH1A1 P00352 4/20 0.34
MAPK1 P28482 3/20 0.34
ALOX15 P16050 3/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PKM P14618 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 3/20 0.32
MITF O75030 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
MAPT P10636 2/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL22564192 0.92 HPGD (0.35) HPGDHSD17B10ALDH1A1MAPK1ALOX15
SCHEMBL22564165 0.91 HPGD (0.35) HPGDHSD17B10ALDH1A1MAPK1ALOX15
SCHEMBL22564174 0.90
SCHEMBL22564517 0.89 HSD17B10 (0.33) HPGDHSD17B10ALDH1A1MAPK1ALOX15
SCHEMBL22564158 0.89 ALDH1A1 (0.34) HPGDHSD17B10ALDH1A1L3MBTL1PKM
SCHEMBL22564478 0.88 HSD17B10 (0.38) HPGDHSD17B10ALDH1A1MAPK1L3MBTL1
SCHEMBL22564272 0.88 NR1H4 (0.35) HPGDHSD17B10ALDH1A1MAPK1ALOX15
SCHEMBL22564337 0.87 HSD17B10 (0.33) HPGDHSD17B10ALDH1A1MAPK1ALOX15
SCHEMBL22563956 0.87 HSD17B10 (0.33) HPGDHSD17B10ALDH1A1MAPK1ALOX15
SCHEMBL22563939 0.85 TSHR (0.38) HSD17B10ALDH1A1MAPK1L3MBTL1LMNA

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