SCHEMBL23636028

SCHEMBL23636028

CCCN1CCn2ncc(=O)c(OCOC(=S)OCC)c2C1=O

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.32
▸ GAA P10253 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ TDP1 Q9NUW8 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
SCHEMBL22745311 0.88 POLB (0.34) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL19935363 0.84 POLB (0.38) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL19935294 0.82 POLB (0.33) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL22745132 0.82 POLB (0.33) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL22745380 0.81 POLB (0.32) POLBGAA
SCHEMBL22745131 0.80 POLB (0.31) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL22745500 0.77 POLB (0.40) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL22745249 0.76 POLB (0.38) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL22193785 0.75 POLB (0.36) POLBGAAKDM4EALDH1A1HPGD
SCHEMBL19935299 0.74 POLB (0.38) POLBGAAKDM4EALDH1A1HPGD

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
EP-3848372-A1 FUSED TRICYCLIC PYRIDAZINONE COMPOUNDS USEFUL TO TREAT ORTHOMYXOVIRUS INFECTIONS Novartis AG (CH) 2021-07-14 — — EP disclosed
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