SCHEMBL29006151

SCHEMBL29006151

O[C@@H](C[Se]c1ccccc1)c1cc[c]cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.47
CA1 P00915 4/20 0.41
CA2 P00918 4/20 0.41
CA7 P43166 4/20 0.41
CA4 P22748 3/20 0.41
CA9 Q16790 3/20 0.41
LMNA P02545 1/20 0.38
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
AOC3 Q16853 5/20 0.35
RIPK1 Q13546 1/20 0.33
BCAT2 O15382 1/20 0.32
BBOX1 O75936 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL29006211 0.87 MAOA (0.55) MAOACA1CA2CA7CA4
SCHEMBL29006212 0.87 MAOA (0.55) MAOACA1CA2CA7CA4
SCHEMBL29006220 0.80 MAOA (0.48) MAOACA1CA2CA7CA4
SCHEMBL29006200 0.80 MAOA (0.53) MAOACA1CA2CA7CA4
SCHEMBL29006221 0.80 MAOA (0.48) MAOACA1CA2CA7CA4
SCHEMBL29006203 0.80 MAOA (0.53) MAOACA1CA2CA7CA4
SCHEMBL29006167 0.79 MAOA (0.52) MAOACA1CA2CA7CA4
SCHEMBL29006195 0.79 MAOA (0.49) MAOACA1CA2CA7CA4
SCHEMBL29006201 0.79 MAOA (0.47) MAOACA1CA2CA7CA4
SCHEMBL29006199 0.79 MAOA (0.47) MAOACA1CA2CA7CA4

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
CN-116178232-A Chiral hydroxy seleno ether and asymmetric synthesis method thereof 湖北滋兰生物医药科技有限公司 2023-05-30 CN disclosed