SCHEMBL18525646

SCHEMBL18525646

CC(C)Oc1cc2c(OC3CCCN(C(=O)OC(C)(C)C)C3)ccnc2cc1C(N)=O

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 0.62

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
SCHEMBL18525645 1.00 IRAK4 (0.62) IRAK4
SCHEMBL18497765 0.95 IRAK4 (0.59) IRAK4
SCHEMBL18497764 0.95 IRAK4 (0.59) IRAK4
SCHEMBL18497822 0.95 IRAK4 (0.59) IRAK4
SCHEMBL17148571 0.90 IRAK4 (0.61) IRAK4
SCHEMBL18497836 0.89 CHEK2 (0.48) IRAK4
SCHEMBL18497837 0.89 CHEK2 (0.48) IRAK4
SCHEMBL18497748 0.89 IRAK4 (0.67) IRAK4
SCHEMBL18497817 0.88 CHEK2 (0.47) IRAK4
SCHEMBL18497816 0.88 CHEK2 (0.47) 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
WO-2017025849-A1 BICYCLIC-FUSED HETEROARYL OR ARYL COMPOUNDS PFIZER INC. (US) 2017-02-16 — — WO disclosed
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