SCHEMBL25075397

SCHEMBL25075397

CC(=O)C1CCC(C2CN(C)C2)CC1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33
HTT P42858 1/20 0.32
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA7 P36544 1/20 0.31
CHRNA4 P43681 1/20 0.31
HSD11B1 P28845 1/20 0.31
HSD11B2 P80365 1/20 0.31
ALDH1A1 P00352 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
SCHEMBL14336925 0.83 MAPT (0.33) MAPTCHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL16002903 0.83 MEN1 (0.41) MAPTALDH1A1
SCHEMBL16837171 0.78
SCHEMBL761653 0.76
SCHEMBL13165512 0.75 MAPT (0.38) MAPTHTTALDH1A1
SCHEMBL2617044 0.75 MAPT (0.38) MAPTHTTALDH1A1
SCHEMBL13165462 0.75 MAPT (0.38) MAPTHTTALDH1A1
SCHEMBL76462 0.75
SCHEMBL26522637 0.75 HSD11B1 (0.39) HRH3CHRNB2CHRNB4CHRNA3CHRNA7
SCHEMBL14877965 0.75 EPHX1 (0.34) MAPTALDH1A1

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-2023023537-A1 COMPOUNDS AND METHODS FOR THE TARGETED DEGRADATION OF BRUTON'S TYROSINE KINASE ENDOTARGET INC. (US) 2023-02-23 WO disclosed