SCHEMBL30516180

SCHEMBL30516180

CC1(C(=O)O[C@H]2O[C@@](C#N)(c3ccc4c(N)ncnn34)[C@H](O)[C@@H]2O)CCCC1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TMPRSS2 O15393 1/20 0.41
▸ PIK3CD O00329 2/20 0.31
▸ POLRMT O00411 1/20 0.30

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
SCHEMBL30165917 0.99 TMPRSS2 (0.40) TMPRSS2PIK3CDPOLRMT
Bromide SCHEMBL30165903 0.98 TMPRSS2 (0.40) TMPRSS2PIK3CD
Sulfuric Acid SCHEMBL30165951 0.96 TMPRSS2 (0.39) TMPRSS2
Sulfuric Acid SCHEMBL30165901 0.96 TMPRSS2 (0.39) TMPRSS2
Phosphoric Acid SCHEMBL30165932 0.96 TMPRSS2 (0.40) TMPRSS2POLRMT
SCHEMBL31325796 0.95 TMPRSS2 (0.40) TMPRSS2PIK3CD
Maleic Acid SCHEMBL30165883 0.94 TMPRSS2 (0.38) TMPRSS2
SCHEMBL31239302 0.87 TMPRSS2 (0.39) TMPRSS2
SCHEMBL31239307 0.87 TMPRSS2 (0.39) TMPRSS2
SCHEMBL31239301 0.87 TMPRSS2 (0.39) TMPRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117599063-B Application of nucleoside compound in preparation of poxvirus related products 深圳安泰维生物医药有限公司 2024-11-15 — — CN disclosed
CN-118027040-A Nucleoside compound for treating coronavirus infection and application thereof 南方科技大学 2024-05-14 — — CN disclosed
CN-117964624-A Nucleoside compound with effect of treating viral infection and application thereof 南方科技大学 2024-05-03 — — CN disclosed
CN-117777141-A Nucleoside compound for resisting virus infection and application thereof 南方科技大学 2024-03-29 — — CN disclosed
CN-117599063-A Application of nucleoside compound in preparation of poxvirus related products 深圳安泰维生物医药有限公司 2024-02-27 — — CN disclosed
CN-116370479-B Use of compound ATV014 in the preparation of a product for the treatment of novel coronavirus infection 南方科技大学 2024-02-13 — — CN disclosed
CN-113735862-B Nucleoside compound for treating viral infection and application thereof 南方科技大学 2024-02-02 — — CN disclosed
CN-116874490-A Compound ATV014 or pharmaceutically acceptable salts thereof and pharmaceutical compositions thereof 南方科技大学 2023-10-13 — — CN disclosed
CN-116370479-A Use of compound ATV014 in the preparation of a product for the treatment of novel coronavirus infection 南方科技大学 2023-07-04 — — CN disclosed
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