SCHEMBL19854889

SCHEMBL19854889

Cn1cc(O[C@@H]2OC(CO)[C@@H](O)C(O)C2O)c2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.56
EPHX2 P34913 1/20 0.54
SLC5A2 P31639 7/20 0.53
SLC5A1 P13866 4/20 0.51
SLC28A3 Q9HAS3 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
TYR P14679 2/20 0.48
ACHE P22303 1/20 0.47
CD209 Q9NNX6 1/20 0.46

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
SCHEMBL17439159 1.00 ATM (0.56) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL233859 1.00 ATM (0.56) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL19846979 1.00 ATM (0.56) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL6561299 1.00 ATM (0.56) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL29461029 1.00 ATM (0.56) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL3191173 1.00 ATM (0.56) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL3648218 0.85 SLC5A2 (0.42) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL22412720 0.85 SLC5A2 (0.42) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL19846978 0.83 SLC28A3 (0.54) ATMEPHX2SLC5A2SLC5A1SLC28A3
SCHEMBL8516031 0.83 KMT2A (0.51) ATMEPHX2SLC5A2SLC5A1SLC28A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220136024-A1 PROTECTING GROUP CHEMISTRY FOR CLEAN, REDUCTANT-FREE DYEING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-05-05 US disclosed
US-11203774-B2 Protecting group chemistry for clean, reductant-free dyeing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-12-21 US disclosed
US-20200325516-A1 PROTECTING GROUP CHEMISTRY FOR CLEAN, REDUCTANT-FREE DYEING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-10-15 US disclosed
US-10704070-B2 Protecting group chemistry for clean, reductant-free dyeing THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2020-07-07 US disclosed
US-20180037917-A1 PROTECTING GROUP CHEMISTRY FOR CLEAN, REDUCTANT-FREE DYEING THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-02-08 US disclosed