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SCHEMBL27369965

SCHEMBL27369965

CSCC(NC(=O)c1c[nH]c(C(=O)c2cccc(C(C)C)c2)c1-c1c(F)ccc(F)c1C)c1cccc(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 11/20 0.38
▸ AURKA O14965 2/20 0.38
▸ CDK2 P24941 2/20 0.38
▸ DCAF1 Q9Y4B6 6/20 0.36
▸ ROCK2 O75116 2/20 0.36
▸ MAPK3 P27361 2/20 0.34
▸ ROCK1 Q13464 1/20 0.34
▸ TAOK1 Q7L7X3 1/20 0.34
▸ PRKD2 Q9BZL6 1/20 0.34

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
SCHEMBL27369980 0.95 MAPK1 (0.38) MAPK1AURKACDK2DCAF1ROCK2
SCHEMBL27369930 0.90 MAPK1 (0.38) MAPK1AURKACDK2DCAF1ROCK2
SCHEMBL27369957 0.88 MAPK1 (0.39) MAPK1AURKACDK2DCAF1MAPK3
SCHEMBL27369938 0.85 MAPK1 (0.42) MAPK1AURKACDK2DCAF1ROCK2
SCHEMBL27369934 0.85 DCAF1 (0.48) MAPK1AURKACDK2DCAF1ROCK2
SCHEMBL27369968 0.83 MAPK1 (0.35) MAPK1AURKACDK2DCAF1ROCK2
SCHEMBL27369904 0.78 DCAF1 (0.51) MAPK1AURKACDK2DCAF1
SCHEMBL35212183 0.74 DCAF1 (0.43) MAPK1AURKACDK2DCAF1
SCHEMBL35212462 0.74 DCAF1 (0.43) MAPK1AURKACDK2DCAF1
SCHEMBL35212428 0.74 DCAF1 (0.43) MAPK1AURKACDK2DCAF1

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-2024092011-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2024-05-02 — — WO disclosed