SCHEMBL11705148

SCHEMBL11705148

CC1CCCCN([Si](C)(C)C)C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA4 P22748 1/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM3 P20309 2/20 0.39
KMT2A Q03164 1/20 0.38
PIK3CD O00329 1/20 0.35
GAA P10253 2/20 0.33
HPGD P15428 1/20 0.33
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
ALDH1A1 P00352 2/20 0.32
HTT P42858 3/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 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
SCHEMBL19421185 0.72 CA1 (0.43) CA1CA2CA4CHRM2CHRM4
SCHEMBL13502662 0.72 CA1 (0.43) CA1CA2CA4CHRM2CHRM4
SCHEMBL6956809 0.72
SCHEMBL22147821 0.71 CA1 (0.41) CA1CA2CA4CHRM2CHRM4
SCHEMBL10417960 0.71
SCHEMBL11036434 0.70 ALDH1A1 (0.37) CA1CA2CA4KMT2ASMN1; SMN2
SCHEMBL8196101 0.69 ENO1 (0.44) CA1CA2CA4CHRM2CHRM4
SCHEMBL22680910 0.69 TSHR (0.31) KMT2AALDH1A1LIPE
SCHEMBL996315 0.67 CHRM2 (0.38) CA1CA2CA4CHRM2CHRM4
SCHEMBL2207321 0.67 PIK3CD (0.38) CHRM2CHRM4CHRM5CHRM1CHRM3

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-4038470-A METHOD FOR PREPARATION OF POLYMERS WHICH CONTAIN N-ACYLLACTAM GROUPS CESKOSLOVENSKA AKADEMIE VED (CS) 1977-07-26 US disclosed