SCHEMBL1551660

SCHEMBL1551660

CC(C)N(C(C)C)C(NP(O)O)N(C(C)C)C(C)C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL23273093 0.74
SCHEMBL1441833 0.65
SCHEMBL79661 0.61 ALDH1A1 (0.39)
SCHEMBL35663 0.61 ALDH1A1 (0.39)
SCHEMBL9275790 0.61
Methyl Alcohol SCHEMBL2866912 0.60 ALDH1A1 (0.33)
Hydrogen Peroxide SCHEMBL135349 0.60 ALDH1A1 (0.33)
Hydrogen Peroxide SCHEMBL135351 0.60 ALDH1A1 (0.33)
SCHEMBL991455 0.59
SCHEMBL3751552 0.58 ALDH1A1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9045520-B2 Synthesis of purine nucleosides GILEAD PHARMASSET LLC (US) 2015-06-02 US disclosed
EP-2313422-B1 NUCLEOSIDE CYCLICPHOSPHATES GILEAD PHARMASSET LLC (US) 2015-03-04 EP disclosed
US-8759510-B2 Nucleoside cyclicphosphates GILEAD PHARMASSET LLC (US) 2014-06-24 US disclosed
US-8716263-B2 Synthesis of purine nucleosides GILEAD PHARMASSET LLC (US) 2014-05-06 US disclosed
EP-2671888-A1 3',5'-cyclic nucleoside phosphate analogues Gilead Pharmasset LLC (US) 2013-12-11 EP disclosed
US-20120316327-A1 SYNTHESIS OF PURINE NUCLEOSIDES GILEAD PHARMASSET LLC (US) 2012-12-13 US disclosed
US-20120258928-A1 NUCLEOSIDE CYCLICPHOSPHATES GILEAD PHARMASSET LLC (US) 2012-10-11 US disclosed
US-8173621-B2 Nucleoside cyclicphosphates GILEAD PHARMASSET LLC (US) 2012-05-08 US disclosed
EP-2313422-A2 NUCLEOSIDE CYCLICPHOSPHATES Pharmasset, Inc. (US) 2011-04-27 EP disclosed
US-20100279973-A1 SYNTHESIS OF PURINE NUCLEOSIDES PHARMASSET, INC. (US) 2010-11-04 US disclosed
US-20100081628-A1 NUCLEOSIDE CYCLICPHOSPHATES PHARMASSET, INC. (US) 2010-04-01 US disclosed
WO-2009152095-A2 NUCLEOSIDE CYCLICPHOSPHATES PHARMASSET, INC. (US) 2009-12-17 WO disclosed