SCHEMBL28157635

SCHEMBL28157635

CCC(=O)OC(C)C.CCN(CC)CC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
TSHR P16473 2/20 0.39
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM5 P08912 2/20 0.36
CHRM1 P11229 2/20 0.36
CHRM3 P20309 2/20 0.36
MEN1 O00255 1/20 0.35
CYP2C19 P33261 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP2D6 P10635 1/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ADRA1A P35348 1/20 0.31
PDE4D Q08499 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
SCN1A P35498 1/20 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
SCHEMBL128684 0.88
SCHEMBL31019825 0.88 LMNA (0.54) LMNATSHRMEN1CYP2C19RECQL
Hydrochloric Acid SCHEMBL29626546 0.85 LMNA (0.52) LMNATSHRMEN1CYP2C19RECQL
Phosphine SCHEMBL28136081 0.85
SCHEMBL28090408 0.85
Propane SCHEMBL28528148 0.85 LMNA (0.52) LMNATSHRMEN1CYP2C19RECQL
SCHEMBL28757042 0.85
Bromide SCHEMBL30338324 0.85
Ethane SCHEMBL28426694 0.85 LMNA (0.52) LMNATSHRMEN1CYP2C19RECQL
Methane SCHEMBL28128916 0.85

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105199011-B Chitosan two(Aromatic radical carbamate)‑(Oxyl formamide), its chiral stationary phase and preparation method thereof 武汉工程大学 2017-08-18 CN disclosed
CN-105153327-B Shitosan oxyl formamide and preparation method thereof 武汉工程大学 2017-06-16 CN disclosed