SCHEMBL31684196

CC(C)(C)C(=O)SCCOP(=O)(OC[C@H]1O[C@@](C#N)(c2ccc3c(N)ncnn23)[C@H](O)[C@@H]1O)Oc1ccc(C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 5)

	gene	UniProt	supporting neighbours	confidence
▸	TMPRSS2	O15393	1/20	0.42

▸	CA12	O43570	2/20	0.32

▸	CA1	P00915	2/20	0.32

▸	CA2	P00918	2/20	0.32

▸	CA9	Q16790	2/20	0.32

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.

Compound	similarity	top predicted	shared targets
SCHEMBL10120864	0.92	TMPRSS2 (0.43)	TMPRSS2CA12CA1CA2CA9
SCHEMBL24119311	0.92	TMPRSS2 (0.43)	TMPRSS2CA12CA1CA2CA9
SCHEMBL30921667	0.90	TMPRSS2 (0.34)	TMPRSS2CA12CA1CA2CA9
SCHEMBL30921680	0.90	TMPRSS2 (0.34)	TMPRSS2CA12CA1CA2CA9
SCHEMBL30921682	0.90	TMPRSS2 (0.34)	TMPRSS2CA12CA1CA2CA9
SCHEMBL31684208	0.90	TMPRSS2 (0.34)	TMPRSS2CA12CA1CA2CA9
SCHEMBL22646485	0.90	TMPRSS2 (0.42)	TMPRSS2CA12CA1CA2CA9
SCHEMBL30939825	0.88	TMPRSS2 (0.41)	TMPRSS2
SCHEMBL30921697	0.88	TMPRSS2 (0.41)	TMPRSS2
SCHEMBL30939781	0.88	TMPRSS2 (0.43)	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 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
EP-4617278-A1	NUCLEOTIDE ANALOG, AND COMPOSITION AND USE THEREOF	Shenzhen TargetRx, Inc. (CN)	2025-09-17	—	—	EP	disclosed