SCHEMBL29006146

SCHEMBL29006146

Cc1cc(C)cc([Se]C[C@H](O)c2ccccc2)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.46
TACR1 P25103 5/20 0.45
HTT P42858 1/20 0.42
MAOA P21397 1/20 0.42
AOC3 Q16853 5/20 0.41
KDM4E B2RXH2 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
RIPK1 Q13546 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TAAR1 Q96RJ0 1/20 0.38
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL29006149 1.00 LMNA (0.46) LMNATACR1HTTMAOAAOC3
SCHEMBL29006191 0.87 TAAR1 (0.46) LMNAHTTMAOAAOC3KDM4E
SCHEMBL29006189 0.87 TAAR1 (0.46) LMNAHTTMAOAAOC3KDM4E
SCHEMBL29006168 0.84 CA7 (0.55) LMNAHTTMAOAAOC3KDM4E
SCHEMBL29006164 0.84 CA7 (0.55) LMNAHTTMAOAAOC3KDM4E
SCHEMBL29006212 0.81 MAOA (0.55) LMNAMAOAAOC3KDM4EL3MBTL1
SCHEMBL29006211 0.81 MAOA (0.55) LMNAMAOAAOC3KDM4EL3MBTL1
SCHEMBL29006167 0.81 MAOA (0.52) LMNAHTTMAOAAOC3KDM4E
SCHEMBL29006163 0.81 MAOA (0.52) LMNAHTTMAOAAOC3KDM4E
SCHEMBL29006200 0.75 MAOA (0.53) LMNAMAOAAOC3KDM4EL3MBTL1

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