SCHEMBL24250076

SCHEMBL24250076

CC(C)Oc1cc2c(OCC3COC3)ccnc2cc1C=O

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 0.68

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
SCHEMBL24250121 0.82 IRAK4 (0.71) IRAK4
SCHEMBL24249981 0.82 IRAK4 (0.70) IRAK4
SCHEMBL17148577 0.81 IRAK4 (1.00) IRAK4
SCHEMBL30497418 0.81 IRAK4 (0.66) IRAK4
SCHEMBL17136943 0.81 IRAK4 (0.66) IRAK4
SCHEMBL24250205 0.81 IRAK4 (0.70) IRAK4
SCHEMBL24250063 0.80 IRAK4 (0.47) IRAK4
SCHEMBL24250204 0.79 IRAK4 (0.76) IRAK4
SCHEMBL24250079 0.77 IRAK4 (0.68) IRAK4
SCHEMBL24250212 0.74 IRAK4 (0.44) IRAK4

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-3536685-B1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS AND THEIR USE AS IRAK4 INHIBITORS PFIZER (US) 2022-02-16 — — EP disclosed
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