SCHEMBL11219359

SCHEMBL11219359

CC(O)C(=O)ON1CCNCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 1/20 0.37
CHRM3 P20309 1/20 0.37
CA2 P00918 2/20 0.36
CHKA P35790 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
CHRNB2 P17787 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
CHRNB3 Q05901 1/20 0.31
CHRNA6 Q15825 1/20 0.31
CYP1A2 P05177 1/20 0.31
PADI1 Q9ULC6 1/20 0.30
PADI4 Q9UM07 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
SCHEMBL5874892 0.86 CHRM5 (0.38) CHRM5CHRM3CA2CHKASMN1; SMN2
SCHEMBL1642934 0.83 CA2 (0.35) CHRM5CHRM3CA2CHKASMN1; SMN2
SCHEMBL27173938 0.82 CHRM5 (0.36) CHRM5CHRM3CA2CHKASMN1; SMN2
SCHEMBL15153153 0.81 ALDH1A1 (0.32)
SCHEMBL27364958 0.79 CHRM5 (0.38) CHRM5CHRM3CA2SMN1; SMN2CA12
SCHEMBL7718861 0.79 ALDH1A1 (0.36) CA2CHKA
SCHEMBL5874356 0.78 CA2 (0.34) CHRM5CHRM3CA2CHKACA12
SCHEMBL1257515 0.76 ALDH1A1 (0.42) SMN1; SMN2
SCHEMBL18305950 0.75 CHRM5 (0.39) CHRM5CHRM3CA2CHKACA12
SCHEMBL28146990 0.74 CHRM5 (0.33) CHRM5CHRM3

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116585853-A Desulfurizing liquid based on mono-nitrogen (N) -substituted piperazine lactate and preparation method thereof 坤仑(常州)科技有限公司 2023-08-15 CN claimed
CN-116585853-A Desulfurizing liquid based on mono-nitrogen (N) -substituted piperazine lactate and preparation method thereof 坤仑(常州)科技有限公司 2023-08-15 CN disclosed
CN-116585853-A Desulfurizing liquid based on mono-nitrogen (N) -substituted piperazine lactate and preparation method thereof 坤仑(常州)科技有限公司 2023-08-15 CN disclosed
CN-116585853-A Desulfurizing liquid based on mono-nitrogen (N) -substituted piperazine lactate and preparation method thereof 坤仑(常州)科技有限公司 2023-08-15 CN disclosed
US-4322319-A Rubber composition containing crosslinkable processing aid JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1982-03-30 US disclosed