SCHEMBL25645174

SCHEMBL25645174

CCCN1CC(OCCO)C1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 5/20 0.46
GLB1 P16278 1/20 0.34
GAA P10253 1/20 0.34
GUSB P08236 2/20 0.32
TSHR P16473 1/20 0.31
ALDH1A1 P00352 1/20 0.31
NPC1 O15118 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
SCHEMBL23867111 0.85 GBA1 (0.37) GBA1GLB1GUSBNPC1
SCHEMBL22906861 0.79
SCHEMBL15833578 0.79 NPC1 (0.30) NPC1
SCHEMBL24842036 0.79 GBA1 (0.38) GBA1GLB1GAAGUSB
SCHEMBL24658475 0.75 GBA1 (0.36) GBA1GLB1GAAGUSBALDH1A1
SCHEMBL25619074 0.74 PIK3CD (0.41) GBA1
SCHEMBL24138001 0.73 GBA1 (0.43) GBA1GLB1GAAGUSBTSHR
SCHEMBL15833659 0.73 LIPG (0.35) NPC1
SCHEMBL7739926 0.72 GUSB (0.48) GBA1GLB1GUSB
SCHEMBL21290852 0.72 PDCD1 (0.37) GBA1GLB1

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
WO-2023097189-A1 AMPK ACTIVATORS KALLYOPE, INC. (US) 2023-06-01 WO disclosed