SCHEMBL4778024

SCHEMBL4778024

COc1ccc(C(OC[C@@]23CCO[C@@H]([C@H](n4cc(C)c(N)nc4=O)O2)[C@@H]3OP(OCCC#N)N(C(C)C)C(C)C)(c2ccccc2)c2ccc(OC)cc2)cc1

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
SCHEMBL1518261 0.90
SCHEMBL26869 0.89 TK2 (0.33)
SCHEMBL6441180 0.85 P2RY6 (0.33)
SCHEMBL4772315 0.85
SCHEMBL1096446 0.84
SCHEMBL5861676 0.83 TK2 (0.34)
SCHEMBL2768845 0.83 TK2 (0.34)
SCHEMBL5557385 0.83 TK2 (0.34)
SCHEMBL7067321 0.83 TK2 (0.34)
SCHEMBL1099028 0.83 TK2 (0.34)

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
US-7335765-B2 Nucleoside and oligonucleotide analogues DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-02-26 US disclosed
US-20020147332-A1 Novel nucleoside and oligonucleotide analogues SANKYO COMPANY, LIMITED (JP) 2002-10-10 US disclosed