SCHEMBL28288685

SCHEMBL28288685

Cn1cc([Se]c2ccccc2)c(=O)[nH]c1=O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.36
CRBN Q96SW2 1/20 0.35
DAO P14920 7/20 0.35
ADORA3 P0DMS8 1/20 0.34
ADORA2A P29274 1/20 0.34
ADORA2B P29275 1/20 0.34
ADORA1 P30542 1/20 0.34
MAPK1 P28482 1/20 0.34
MET P08581 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
TK2 O00142 1/20 0.33
GFER P55789 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
SCHEMBL28412210 0.80 HPGD (0.36) HPGDDAOMAPK1METGAA
SCHEMBL28287426 0.75 HPGD (0.60) HPGDDAOMAPK1
SCHEMBL7711012 0.75 UPP1 (0.41) HPGDDAOMAPK1TK2
SCHEMBL28288700 0.71 LMNA (0.44) ADORA2AADORA2BLMNA
SCHEMBL15850325 0.70 MET (0.58) HPGDDAOMET
SCHEMBL3953282 0.67 ALDH1A1 (0.50) LMNAGAA
SCHEMBL28417123 0.67 ADORA2B (0.41) HPGDADORA3ADORA2AADORA2BADORA1
SCHEMBL9880650 0.66 ERCC1 (0.49) CRBNADORA3ADORA2AADORA2BADORA1
SCHEMBL28482699 0.64 DAO (0.51) HPGDDAOMAPK1
SCHEMBL16248 0.64 MAPK1 (0.47) HPGDCRBNDAOMAPK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109651267-B Method for preparing 5-sulfur/selenium modified uracil derivative 中国科学院化学研究所 2020-05-19 CN disclosed
CN-109651267-A Prepare 5- sulphur/selenium modification uracil derivative method 中国科学院化学研究所 2019-04-19 CN disclosed