SCHEMBL28869663

SCHEMBL28869663

BrCc1nc(-c2ccc(Br)cc2)no1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 8/20 0.71
TDP1 Q9NUW8 2/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
HTT P42858 2/20 0.56
NR1H4 Q96RI1 1/20 0.56
RAB9A P51151 4/20 0.54
NPC1 O15118 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.49
TSHR P16473 2/20 0.49
NOTUM Q6P988 3/20 0.49
HPGD P15428 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
LMNA P02545 1/20 0.46

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
SCHEMBL15299292 0.84 SIRT2 (0.64) SIRT2TDP1MEN1KMT2AL3MBTL1
SCHEMBL10937283 0.84 SIRT2 (0.71) SIRT2TDP1MEN1KMT2AL3MBTL1
SCHEMBL10173253 0.84 SMN1; SMN2 (0.59) TDP1L3MBTL1HTTRAB9ANPC1
SCHEMBL201986 0.84 SIRT2 (0.71) SIRT2TDP1L3MBTL1HTTRAB9A
SCHEMBL14788168 0.80 SIRT2 (0.74) SIRT2TDP1MEN1KMT2AL3MBTL1
SCHEMBL15287156 0.77 SIRT2 (0.56) SIRT2TDP1MEN1KMT2AL3MBTL1
SCHEMBL22530395 0.77 SIRT2 (0.56) SIRT2TDP1MEN1KMT2AL3MBTL1
SCHEMBL12433084 0.76 ERCC1 (0.55) SIRT2NOTUM
SCHEMBL6328232 0.76 TSHR (0.74) SIRT2RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL203702 0.76 S1PR1 (0.55) SIRT2TDP1MEN1KMT2AL3MBTL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115093377-B Haloalkyl-containing 1,2, 4-oxadiazole derivative and preparation method and application thereof 贵州大学 2023-04-07 CN claimed
CN-115093377-A Haloalkyl-containing 1,2, 4-oxadiazole derivative and preparation method and application thereof 贵州大学 2022-09-23 CN claimed
CN-115093377-B Haloalkyl-containing 1,2, 4-oxadiazole derivative and preparation method and application thereof 贵州大学 2023-04-07 CN disclosed
CN-115093377-A Haloalkyl-containing 1,2, 4-oxadiazole derivative and preparation method and application thereof 贵州大学 2022-09-23 CN disclosed