SCHEMBL16070117

SCHEMBL16070117

CC(=O)O[C@]12C[C@H]1C[C@]1(OC(C)=O)C=CO[C@H]21

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
SCHEMBL20259577 1.00 — —
SCHEMBL17414095 0.65 — —
SCHEMBL20259610 0.65 — —
SCHEMBL16070113 0.65 — —
SCHEMBL16070118 0.64 — —
SCHEMBL16070441 0.63 — —
SCHEMBL17414093 0.63 — —
SCHEMBL20259611 0.63 — —
SCHEMBL9707294 0.62 ALOX15 (0.33) —
SCHEMBL20094562 0.58 CYP19A1 (0.32) —

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-20180162897-A1 TRICYCLIC NUCLEOSIDES AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM UNIVERSITAET BERN (CH) 2018-06-14 — — US disclosed
US-9862742-B2 Tricyclic nucleosides and oligomeric compounds prepared therefrom Universität Bern (CH) 2018-01-09 — — US disclosed
US-20160002280-A1 TRICYCLIC NUCLEOSIDES AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM UNIVERSITAT BERN (CH) 2016-01-07 — — US disclosed
US-20160002280-A1 TRICYCLIC NUCLEOSIDES AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM UNIVERSITAT BERN (CH) 2016-01-07 — — US disclosed
WO-2014140348-A1 TRICYCLIC NUCLEOSIDES AND OLIGOMERIC COMPOUNDS PREPARED THEREFROM Universität Bern (CH) 2014-09-18 — — WO disclosed
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