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Sugi Predict / Compounds / SCHEMBL13716191

SCHEMBL13716191

SCHEMBL13716191

C[C@H]1C2OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(=O)[nH]c(N)nc54)[C@@H](O)C3OP(=O)(O)OCC[C@H]2O[C@H]1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 19/20 0.81
▸ PDE3B Q13370 1/20 0.81
▸ PDE3A Q14432 1/20 0.81

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
SCHEMBL13716539 0.96 STING1 (0.74) STING1PDE3BPDE3A
SCHEMBL13687898 0.95 STING1 (0.90) STING1PDE3BPDE3A
SCHEMBL13341132 0.95 STING1 (0.90) STING1PDE3BPDE3A
SCHEMBL13341146 0.95 STING1 (0.90) STING1PDE3BPDE3A
SCHEMBL19503177 0.92 STING1 (0.83) STING1PDE3BPDE3A
SCHEMBL13716288 0.92 STING1 (0.83) STING1PDE3BPDE3A
SCHEMBL13341171 0.91 STING1 (0.81) STING1PDE3BPDE3A
SCHEMBL13687901 0.91 STING1 (0.81) STING1PDE3BPDE3A
SCHEMBL13341133 0.91 STING1 (0.81) STING1PDE3BPDE3A
SCHEMBL13716125 0.91 STING1 (0.85) STING1PDE3BPDE3A

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
US-7569555-B2 Method for stimulating the immune, inflammatory or neuroprotective response KARAGEN PHARMACEUTICALS 2009-08-04 — — US disclosed
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