SCHEMBL29330814

Nc1ncnc2c1[nH]c(=O)n2[C@H]1C[C@H](O)[C@@H](COP(=O)(S)O[C@@H]2C[C@@H](COP(=O)(O)S)O[C@H]2n2cnc3cc(Cl)c(Cl)cc32)O1

nearest known ligand 0.43

Predicted protein targets (top 10)

	gene	UniProt	supporting neighbours	confidence
▸	DTYMK	P23919	4/20	0.43

▸	POLB	P06746	2/20	0.40

▸	ENPP1	P22413	3/20	0.38

▸	P2RY1	P47900	1/20	0.38

▸	NT5E	P21589	1/20	0.37

▸	TRPM2	O94759	1/20	0.36

▸	F2	P00734	1/20	0.35

▸	ATG7	O95352	2/20	0.35

▸	PRMT5	O14744	1/20	0.34

▸	METTL3	Q86U44	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.

Compound	similarity	top predicted	shared targets
SCHEMBL29330906	0.87	DTYMK (0.45)	DTYMKPOLBENPP1P2RY1
SCHEMBL29324308	0.87	DTYMK (0.45)	DTYMKPOLBENPP1P2RY1
SCHEMBL23679479	0.86	DTYMK (0.36)	DTYMKPOLBENPP1P2RY1TRPM2
SCHEMBL23679478	0.86	DTYMK (0.34)	DTYMKPOLBP2RY1TRPM2
SCHEMBL21896065	0.86	DTYMK (0.40)	DTYMKPOLBENPP1P2RY1TRPM2
SCHEMBL23679569	0.82	POLB (0.49)	DTYMKPOLBENPP1P2RY1TRPM2
SCHEMBL23679483	0.81	DTYMK (0.34)	DTYMKPOLB
SCHEMBL29324269	0.80	FHIT (0.39)	DTYMKENPP1P2RY1NT5ETRPM2
SCHEMBL29324317	0.79	POLB (0.41)	DTYMKPOLB
SCHEMBL21896050	0.78	DTYMK (0.47)	DTYMKPOLBENPP1P2RY1TRPM2

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-3854799-B1	CYCLIC DINUCLEOTIDE ANALOGUE, PHARMACEUTICAL COMPOSITION THEREOF, AND APPLICATION	SHANGHAI DE NOVO PHARMATECH CO LTD (CN)	2024-07-17	—	—	EP	disclosed