SCHEMBL14537357

SCHEMBL14537357

COCC#C/C(=N\OC[C@H]1COCCN1)C(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 2/20 0.32

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
SCHEMBL9973622 1.00 IRAK4 (0.32) IRAK4
SCHEMBL6956816 0.88 IRAK4 (0.33) IRAK4
SCHEMBL6958666 0.85 IRAK4 (0.34) IRAK4
SCHEMBL6956713 0.85 IRAK4 (0.34) IRAK4
SCHEMBL15304826 0.84 — —
SCHEMBL9975285 0.76 IRAK4 (0.39) IRAK4
SCHEMBL9975260 0.76 IRAK4 (0.39) IRAK4
SCHEMBL6978846 0.72 IRAK4 (0.34) IRAK4
SCHEMBL6976999 0.72 IRAK4 (0.34) IRAK4
SCHEMBL6978053 0.72 IRAK4 (0.32) 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
US-8349857-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2013-01-08 — — US disclosed
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