SCHEMBL28997348

SCHEMBL28997348

Cc1cn([C@@H]2O[C@H](CO)[C@H](O)[C@H]2OF)c(=O)n(P(O)(O)=S)c1=O

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TK2 O00142 2/20 0.42
▸ P2RY2 P41231 1/20 0.37
▸ TYMP P19971 4/20 0.37
▸ ADORA1 P30542 1/20 0.35
▸ SLC5A2 P31639 1/20 0.34

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
SCHEMBL28997182 0.91 TK2 (0.43) TK2P2RY2TYMPADORA1SLC5A2
SCHEMBL28997185 0.91 TK2 (0.43) TK2P2RY2TYMPADORA1SLC5A2
SCHEMBL17504390 0.82 TK2 (0.42) TK2P2RY2TYMPSLC5A2
SCHEMBL2344104 0.75 TK2 (0.53) TK2TYMP
SCHEMBL5580059 0.75 TK2 (0.66) TK2TYMP
SCHEMBL16042095 0.75 TK2 (0.66) TK2TYMP
SCHEMBL28997350 0.74 PDE4D (0.34) TYMP
SCHEMBL20641804 0.74 TK2 (0.41) TK2P2RY2TYMPADORA1
SCHEMBL31685600 0.73 TK2 (0.44) TK2TYMP
SCHEMBL5697563 0.73 LMNA (0.46) TK2ADORA1

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
CN-116096383-A Compositions and methods for treating hepatitis delta virus infection 杨森制药公司 2023-05-09 — — CN disclosed
CN-116042627-A siRNA and conjugate thereof 赛诺瑞生物医药技术(无锡)有限公司 2023-05-02 — — CN disclosed
CN-115927337-A siRNA and conjugate thereof 赛诺瑞生物医药技术(无锡)有限公司 2023-04-07 — — CN disclosed
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