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Sugi Predict / Compounds / SCHEMBL29973044

SCHEMBL29973044

SCHEMBL29973044

CCCC(CCC)C(=O)[C@@]1(n2ccc(N)nc2=O)O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)C1(F)F

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 1/20 0.36
▸ PDE4D Q08499 1/20 0.34
▸ PDE3A Q14432 1/20 0.34
▸ SLC29A1 Q99808 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL29479249 0.86 PDE3A (0.44) POLA1PDE4DPDE3ASLC29A1L3MBTL1
SCHEMBL19644955 0.75 PDE4D (0.38) POLA1PDE4DPDE3ASLC29A1L3MBTL1
SCHEMBL30568783 0.73 PDE3A (0.44) POLA1PDE4DPDE3ASLC29A1
SCHEMBL29597277 0.71 PDE3A (0.44) POLA1PDE4DPDE3ASLC29A1L3MBTL1
SCHEMBL4747644 0.69 PDE3A (0.47) POLA1PDE4DPDE3ASLC29A1
SCHEMBL25390812 0.69 PDE3A (0.68) POLA1PDE4DPDE3ASLC29A1L3MBTL1
SCHEMBL16426708 0.69 PDE3A (0.68) POLA1PDE4DPDE3ASLC29A1L3MBTL1
SCHEMBL23153089 0.69 PDE3A (0.68) POLA1PDE4DPDE3ASLC29A1L3MBTL1
SCHEMBL18573352 0.69 PDE3A (0.68) POLA1PDE4DPDE3ASLC29A1L3MBTL1
SCHEMBL381952 0.69 PDE3A (0.68) POLA1PDE4DPDE3ASLC29A1L3MBTL1

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
CN-117015383-A Multifunctional cyclic dinucleotide and application thereof 泰励生物科技（上海）有限公司 2023-11-07 — — CN disclosed
CN-115160392-A Multifunctional cyclic dinucleotide and application thereof 泰励生物科技（上海）有限公司 2022-10-11 — — CN disclosed