SCHEMBL28652971

SCHEMBL28652971

CC(=O)OC(C(N)=O)C(OC(C)=O)C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
LMNA P02545 3/20 0.39
ALOX15 P16050 2/20 0.39
BLM P54132 2/20 0.39
PMP22 Q01453 1/20 0.39
CHRM2 P08172 2/20 0.36
CHRM4 P08173 2/20 0.36
CHRM1 P11229 2/20 0.36
TBXA2R P21731 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
GALR3 O60755 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
HRH1 P35367 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
PGD P52209 1/20 0.32
CHRM5 P08912 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
SCHEMBL10293082 0.90 TSHR (0.40) TSHRLMNAALOX15BLMPMP22
SCHEMBL13615583 0.87 TSHR (0.48) TSHRLMNAALOX15BLMPMP22
SCHEMBL25763520 0.87 TSHR (0.48) TSHRLMNAALOX15BLMPMP22
SCHEMBL27659066 0.84 PGD (0.47) TSHRLMNABLMPMP22ALDH1A1
SCHEMBL12957710 0.76 TDP1 (0.58) TSHRLMNACHRM2CHRM4CHRM1
SCHEMBL28036345 0.74
SCHEMBL351872 0.74
SCHEMBL17236094 0.74
SCHEMBL255602 0.73 TSHR (0.50) TSHRLMNAALOX15BLMCHRM2
SCHEMBL13849512 0.73 TSHR (0.50) TSHRLMNAALOX15BLMCHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113563493-B Hydrophobic polysaccharide and preparation method and application thereof 蚌埠医学院 2022-06-24 CN claimed
CN-113563493-B Hydrophobic polysaccharide and preparation method and application thereof 蚌埠医学院 2022-06-24 CN disclosed
CN-113563493-A Hydrophobic polysaccharide and preparation method and application thereof 蚌埠医学院 2021-10-29 CN disclosed