SCHEMBL28627963

SCHEMBL28627963

COc1ccc(C(OC[C@@H]2O[C@@H](n3ccc4c(NC(=O)c5ccccc5)ncnc43)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2CC(=O)O)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 4/20 0.40
▸ ADK P55263 1/20 0.35
▸ PRMT5 O14744 3/20 0.35
▸ WDR77 Q9BQA1 3/20 0.35
▸ TMIGD3 P0DMS9 3/20 0.35
▸ PRMT6 Q96LA8 1/20 0.34
▸ RET P07949 1/20 0.34
▸ KDR P35968 1/20 0.34
▸ METTL3 Q86U44 1/20 0.33

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
SCHEMBL23023830 0.91 TYMP (0.46) TYMPADKPRMT5WDR77METTL3
SCHEMBL18521315 0.91 TYMP (0.46) TYMPADKPRMT5WDR77METTL3
SCHEMBL22381870 0.91 TYMP (0.46) TYMPADKPRMT5WDR77METTL3
SCHEMBL18521074 0.91 TYMP (0.46) TYMPADKPRMT5WDR77METTL3
SCHEMBL23023831 0.90 TYMP (0.46) TYMPADKPRMT5WDR77METTL3
SCHEMBL23023832 0.88 TYMP (0.39) TYMPADKPRMT5WDR77PRMT6
SCHEMBL29814359 0.88 TYMP (0.39) TYMPADKPRMT5WDR77PRMT6
SCHEMBL28645640 0.87 TYMP (0.38) TYMPADKPRMT5WDR77PRMT6
SCHEMBL23702464 0.87 TYMP (0.38) TYMPADKPRMT5WDR77PRMT6
SCHEMBL23702465 0.86 TYMP (0.37) TYMPADKPRMT5WDR77TMIGD3

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109694397-B Cyclic dinucleotide compounds, preparation method and application thereof 上海弘翊生物科技有限公司 2021-08-31 — — CN disclosed
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