SCHEMBL8897235

SCHEMBL8897235

COc1ccc(-c2cn([C@@H]3O[C@H](C)[C@@H](O)[C@H]3O)c3ncnc(Nc4ccccc4)c23)cc1

nearest known ligand 0.93

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ ADK P55263 20/20 0.93

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
SCHEMBL8328653 1.00 ADK (0.93) ADK
SCHEMBL8604872 0.96 ADK (1.00) ADK
SCHEMBL8604868 0.96 ADK (1.00) ADK
SCHEMBL8608954 0.92 ADK (1.00) ADK
SCHEMBL13369885 0.92 ADK (1.00) ADK
SCHEMBL6684942 0.92 ADK (1.00) ADK
SCHEMBL8331187 0.92 ADK (1.00) ADK
SCHEMBL19639134 0.92 ADK (1.00) ADK
SCHEMBL8331847 0.91 ADK (0.88) ADK
SCHEMBL8331850 0.91 ADK (0.88) ADK

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-5646128-A TREATING INFLAMMATION, SEPSIS, SEPTIC SHOCK, BURNS GENSIA, INC. (US) 1997-07-08 — — US disclosed
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