SCHEMBL25906805

SCHEMBL25906805

CC(C)CCCC1COC(=O)O1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 2/20 0.31
PIK3CD O00329 1/20 0.31
FNTA P49354 1/20 0.30
PGGT1B P53609 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
SCHEMBL20955973 0.89 HTT (0.35) HTTPIK3CD
SCHEMBL17227784 0.83
SCHEMBL9999670 0.82 CYP1A2 (0.37) HTTCYP1A2
SCHEMBL17227787 0.81 CYP1A2 (0.40) HTTCYP1A2
SCHEMBL2344886 0.79 CYP1A2 (0.44) CYP1A2
SCHEMBL14539537 0.79 CYP1A2 (0.44) CYP1A2
SCHEMBL2272354 0.78 CYP1A2 (0.51) CYP1A2
SCHEMBL5535987 0.77 PIK3CD (0.34) PIK3CD
SCHEMBL17265372 0.76 CYP1A2 (0.54) CYP1A2
SCHEMBL5598322 0.76 CYP1A2 (0.54) CYP1A2

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
US-11710826-B2 Surface-functionalized silicon anode for high energy lithium ion batteries UCHICAGO ARGONNE, LLC (US) 2023-07-25 US disclosed