SCHEMBL13532223

SCHEMBL13532223

CCCCOC[C@H]1O[C@@H](c2cc(Br)c3c(Cl)ncnn23)[C@](C)(OCCCC)[C@@H]1OCCCC

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
SCHEMBL9912351 0.91 — —
SCHEMBL13532221 0.90 — —
SCHEMBL14140990 0.84 — —
SCHEMBL13392125 0.84 — —
SCHEMBL10100148 0.83 — —
SCHEMBL13532218 0.83 — —
SCHEMBL13532213 0.82 PIK3CD (0.34) —
SCHEMBL10100144 0.81 CSNK2A2 (0.33) —
SCHEMBL12388999 0.81 CSNK2A2 (0.32) —
SCHEMBL14943003 0.81 CSNK2A2 (0.31) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440813-B2 Antiviral nucleoside analogs BIOCRYST PHARMACEUTICALS, INC. (US) 2013-05-14 — — US disclosed
EP-2535345-A1 Anticancer nucleoside analogs BioCryst Pharmaceuticals, Inc. (US) 2012-12-19 — — EP disclosed
US-20100015094-A1 ANTIVIRAL NUCLEOSIDE ANALOGS WILMINGTON TRUST, NATIONAL ASSOCIATION 2010-01-21 — — US disclosed
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