SCHEMBL27436736

SCHEMBL27436736

O=[N+]([O-])OC(O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PDE4A P27815 1/20 0.38
GSR P00390 1/20 0.37
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL27831039 1.00 TDP1 (0.48) TDP1LMNAL3MBTL1PDE4AGSR
SCHEMBL27487804 0.82 TDP1 (0.46) TDP1LMNAL3MBTL1PDE4AGSR
SCHEMBL11096084 0.80 LMNA (0.44) TDP1LMNAL3MBTL1PDE4AGSR
SCHEMBL11099297 0.80 LMNA (0.44) TDP1LMNAL3MBTL1PDE4AGSR
SCHEMBL11096035 0.80 LMNA (0.44) TDP1LMNAL3MBTL1PDE4AGSR
SCHEMBL18585681 0.76 TDP1 (0.48) TDP1LMNAL3MBTL1PDE4AGSR
SCHEMBL1460202 0.76 LMNA (0.39) TDP1LMNAL3MBTL1PDE4AGSR
Mannitol SCHEMBL10952803 0.75 LMNA (0.61) TDP1LMNAL3MBTL1PDE4AUSP2
Mannitol SCHEMBL6690019 0.75 LMNA (0.61) TDP1LMNAL3MBTL1PDE4AUSP2
Mannitol SCHEMBL29085543 0.75 LMNA (0.61) TDP1LMNAL3MBTL1PDE4AUSP2

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-1103316-A Cyclodextrin and polymer based drug delivery system INSITE VISION INC (US) 1995-06-07 CN disclosed