SCHEMBL8912890

SCHEMBL8912890

CC1=CC(=O)OC(C)(CC(C)C)C1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.32
ACHE P22303 1/20 0.32
PIK3CD O00329 1/20 0.32
HDAC1 Q13547 1/20 0.30

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
SCHEMBL8926236 0.98 AKT1 (0.32) AKT1ACHEPIK3CD
SCHEMBL17307358 0.73 MAPT (0.36) AKT1
SCHEMBL13647772 0.72 ACHE (0.37) ACHE
SCHEMBL17307356 0.70 MEN1 (0.36) AKT1
SCHEMBL26977661 0.69
SCHEMBL15477335 0.64 PIK3CD (0.34) AKT1PIK3CD
SCHEMBL28545520 0.63 PIK3CD (0.35) PIK3CDHDAC1
SCHEMBL16885275 0.63 PIK3CD (0.33) PIK3CDHDAC1
SCHEMBL16885277 0.63 PIK3CD (0.33) PIK3CDHDAC1
SCHEMBL17037488 0.63 PIK3CD (0.33) PIK3CDHDAC1

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-1997021699-A1 PROCESS FOR MAKING 1,2-DIOXOLANES ZENECA LIMITED (GB) 1997-06-19 WO disclosed