SCHEMBL18497732

SCHEMBL18497732

CC(C)(C)OC(=O)N1CCC[C@@H](Oc2ccnc3cc(C(N)=O)c(OCc4ccccc4)cc23)C1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 12/20 0.46
▸ CHEK2 O96017 1/20 0.45
▸ PRMT5 O14744 3/20 0.44
▸ PIK3CD O00329 2/20 0.42
▸ PIK3CA P42336 2/20 0.42
▸ PIK3CB P42338 2/20 0.42
▸ PIK3CG P48736 2/20 0.42
▸ TLR9 Q9NR96 2/20 0.42
▸ TLR7 Q9NYK1 2/20 0.42

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
SCHEMBL18497731 1.00 IRAK4 (0.46) IRAK4CHEK2PRMT5PIK3CDPIK3CA
SCHEMBL18525653 0.89 CHEK2 (0.46) CHEK2PRMT5PIK3CDPIK3CAPIK3CB
SCHEMBL18525654 0.89 CHEK2 (0.46) CHEK2PRMT5PIK3CDPIK3CAPIK3CB
SCHEMBL18525645 0.86 IRAK4 (0.62) IRAK4
SCHEMBL18525646 0.86 IRAK4 (0.62) IRAK4
SCHEMBL18497836 0.85 CHEK2 (0.48) IRAK4CHEK2PIK3CDPIK3CAPIK3CB
SCHEMBL18497837 0.85 CHEK2 (0.48) IRAK4CHEK2PIK3CDPIK3CAPIK3CB
SCHEMBL18497816 0.85 CHEK2 (0.47) IRAK4CHEK2PIK3CDPIK3CAPIK3CB
SCHEMBL18497817 0.85 CHEK2 (0.47) IRAK4CHEK2PIK3CDPIK3CAPIK3CB
SCHEMBL18497822 0.81 IRAK4 (0.59) 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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