SCHEMBL29773916

SCHEMBL29773916

CC1(CO)Cc2ccc(F)nc2O1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 3/20 0.33

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
SCHEMBL21326606 1.00 IRAK4 (0.33) IRAK4
SCHEMBL29773940 0.84 — —
SCHEMBL21326702 0.80 IRAK4 (0.33) IRAK4
SCHEMBL30090025 0.80 IRAK4 (0.33) IRAK4
SCHEMBL21326686 0.74 IRAK4 (0.32) IRAK4
SCHEMBL21326688 0.74 IRAK4 (0.43) IRAK4
SCHEMBL24408824 0.72 GRM5 (0.30) —
SCHEMBL24408934 0.71 — —
SCHEMBL29634708 0.71 — —
SCHEMBL21326685 0.71 BRD4 (0.36) 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
CN-109890829-B Pyrazolo [1,5a ] pyrimidine derivatives as IRAK4 modulators 豪夫迈·罗氏有限公司 2022-07-15 — — CN disclosed
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