SCHEMBL30367805

SCHEMBL30367805

CC(C)(C)c1cc(B(O)O)c2c(c1)C(C)(C)c1cc(C(C)(C)C)cc(B(O)O)c1O2

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.37
GABBR1 Q9UBS5 1/20 0.37
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32

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
SCHEMBL2454450 0.82 TRPV6 (0.34) GABBR2GABBR1
SCHEMBL547487 0.79 ALDH1A1 (0.39) GABBR2GABBR1GABRA1GABRB2
SCHEMBL811190 0.78 POLB (0.39) GABBR2GABBR1GABRA1GABRB2
SCHEMBL708899 0.75 GABBR2 (0.36) GABBR2GABBR1GABRA1GABRB2
SCHEMBL14612293 0.75 GABBR2 (0.39) GABBR2GABBR1GABRA1GABRB2
SCHEMBL31462832 0.75 POLB (0.36) GABBR2GABBR1GABRA1GABRB2
SCHEMBL21327677 0.75 POLB (0.36) GABBR2GABBR1GABRA1GABRB2
SCHEMBL4157542 0.75 GABBR2 (0.36) GABBR2GABBR1GABRA1GABRB2
SCHEMBL6504078 0.75 GABBR2 (0.36) GABBR2GABBR1
SCHEMBL29415451 0.73 RXRB (0.39) GABBR2GABBR1

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-119977952-A Cobalt complex with dipyridyl as ligand and synthetic method and application thereof 东莞理工学院 2025-05-13 CN disclosed
CN-115873040-A Mononuclear rhenium complex with bipyridyl xanthene as ligand and preparation method and application thereof 东莞理工学院 2023-03-31 CN disclosed