SCHEMBL27740481

SCHEMBL27740481

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

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.52
PDE4A P27815 1/20 0.50
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
USP2 O75604 1/20 0.47
SLCO1B1 Q9Y6L6 1/20 0.47
KDM4E B2RXH2 2/20 0.35
OR51E2 Q9H255 1/20 0.32
MGAM O43451 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
SCHEMBL1892968 0.98 TDP1 (0.50) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL2122837 0.98 TDP1 (0.50) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL5801967 0.98 TDP1 (0.50) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL27648828 0.91 PDE4A (0.48) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL27844168 0.84 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL28448089 0.84 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL19951539 0.84 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL2341187 0.84 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL2337822 0.84 TDP1 (0.55) TDP1PDE4ALMNAL3MBTL1USP2
SCHEMBL21495088 0.83 TDP1 (0.52) TDP1PDE4ALMNAL3MBTL1USP2

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-101431978-A Water-dispersible patch containing an active agent for dermal delivery EASTMAN CHEM CO (US) 2009-05-13 CN disclosed
CN-101432333-A Water dispersible films for delivery of active agents to the epidermis EASTMAN CHEM CO (US) 2009-05-13 CN disclosed