SCHEMBL22848857

SCHEMBL22848857

COc1cc2nn(C3CCCCC3)cc2cc1NC(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 20/20 0.65
FLT3 P36888 1/20 0.61

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
SCHEMBL26356137 0.92 IRAK4 (0.62) IRAK4FLT3
SCHEMBL23651509 0.91 IRAK4 (0.76) IRAK4FLT3
SCHEMBL31335165 0.91 IRAK4 (0.76) IRAK4FLT3
SCHEMBL22849686 0.91 IRAK4 (0.61) IRAK4FLT3
SCHEMBL22848757 0.90 IRAK4 (0.60) IRAK4FLT3
SCHEMBL24607003 0.88 IRAK4 (0.58) IRAK4FLT3
SCHEMBL24607125 0.88 IRAK4 (0.58) IRAK4FLT3
SCHEMBL24590659 0.87 IRAK4 (0.57) IRAK4FLT3
SCHEMBL22176682 0.87 IRAK4 (0.57) IRAK4FLT3
SCHEMBL22848523 0.87 IRAK4 (0.59) IRAK4FLT3

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-2020264499-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2020-12-30 WO disclosed