SCHEMBL30148835

SCHEMBL30148835

Brc1ccc2c(c1)CC1(CCC1)CO2

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 13/20 0.41
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
BLM P54132 1/20 0.36
AHR P35869 3/20 0.34
APP P05067 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
SCHEMBL28922769 0.97 BACE1 (0.38) BACE1LMNAMAPTHTTBLM
SCHEMBL30148868 0.97 BACE1 (0.38) BACE1LMNAMAPTHTTBLM
SCHEMBL16995784 0.93 BACE1 (0.38) BACE1LMNAMAPTHTTBLM
SCHEMBL28840800 0.87 BACE1 (0.41) BACE1LMNAMAPTHTTBLM
SCHEMBL28840755 0.83 BACE1 (0.38) BACE1LMNAMAPTHTTBLM
SCHEMBL28840720 0.82 BACE1 (0.37) BACE1LMNAMAPTHTTBLM
SCHEMBL4468522 0.80 ENTPD5 (0.40) MAPT
SCHEMBL28840838 0.79 BACE1 (0.38) BACE1LMNAMAPTHTTBLM
SCHEMBL21654389 0.74 APP (0.38) BACE1AHRAPP
SCHEMBL1758994 0.73 LMNA (0.40) BACE1LMNAMAPTHTTBLM

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-115521325-A Boronic acid derivatives 首药控股(北京)股份有限公司 2022-12-27 CN disclosed