SCHEMBL28023609

SCHEMBL28023609

NC(=O)OC(O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
LMNA P02545 4/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
USP2 O75604 1/20 0.45
SLCO1B1 Q9Y6L6 1/20 0.45
PDE4A P27815 1/20 0.43
KDM4E B2RXH2 2/20 0.34
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
CYP2C9 P11712 1/20 0.31
TSHR P16473 1/20 0.31
MGAM O43451 3/20 0.31
MAPT P10636 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
SCHEMBL15720395 0.98 TDP1 (0.48) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL19951539 0.83 TDP1 (0.55) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL2337822 0.83 TDP1 (0.55) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL2341187 0.83 TDP1 (0.55) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL28448089 0.83 TDP1 (0.55) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL27844168 0.83 TDP1 (0.55) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL27740481 0.81 TDP1 (0.52) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL21495088 0.81 TDP1 (0.52) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL1287880 0.80 TDP1 (0.46) TDP1LMNAL3MBTL1USP2SLCO1B1
SCHEMBL9138710 0.80 TDP1 (0.46) TDP1LMNAL3MBTL1USP2SLCO1B1

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
CN-104903341-A Substituted anionic compounds consisting of a backbone consisting of discrete number of saccharide units ADOCIA 2015-09-09 CN disclosed