SCHEMBL30196342

SCHEMBL30196342

CC(C)Oc1cc2c(OC[C@H]3NC(=O)[C@@H]4CNC[C@H]34)nccc2cc1C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 20/20 1.00

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
SCHEMBL25903235 1.00 IRAK4 (1.00) IRAK4
SCHEMBL17137255 1.00 IRAK4 (1.00) IRAK4
SCHEMBL17137077 0.91 IRAK4 (1.00) IRAK4
SCHEMBL30196923 0.91 IRAK4 (1.00) IRAK4
SCHEMBL17137366 0.88 IRAK4 (1.00) IRAK4
SCHEMBL30196729 0.88 IRAK4 (1.00) IRAK4
SCHEMBL25903222 0.87 IRAK4 (1.00) IRAK4
SCHEMBL17148578 0.87 IRAK4 (1.00) IRAK4
SCHEMBL23882630 0.86 IRAK4 (1.00) IRAK4
SCHEMBL17137151 0.86 IRAK4 (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115715194-A Methods of treating coronavirus disease 2019 辉瑞公司 2023-02-24 CN disclosed
EP-4125900-A1 METHODS OF TREATING CORONAVIRUS DISEASE 2019 Pfizer Inc. (US) 2023-02-08 EP disclosed