SCHEMBL29317337

SCHEMBL29317337

CNc1cn(C2CCC(CN3CCN(CC(=O)Nc4cccc5c(C6CCC(=O)NC6=O)nsc45)CC3)CC2)nc1C(F)F

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 1/20 0.37
CRBN Q96SW2 9/20 0.35
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
DDB1 Q16531 3/20 0.31
CCNE2 O96020 1/20 0.30
CDK4 P11802 1/20 0.30
CCND1 P24385 1/20 0.30
CCNE1 P24864 1/20 0.30
CDK2 P24941 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL29329909 0.82 IRAK4 (0.49) IRAK4
SCHEMBL29320520 0.81 IRAK4 (0.61) IRAK4
SCHEMBL29317354 0.81 IRAK4 (0.61) IRAK4
SCHEMBL29317349 0.81 IRAK4 (0.61) IRAK4
SCHEMBL29331380 0.81 IRAK4 (0.61) IRAK4
SCHEMBL29320568 0.81 IRAK4 (0.61) IRAK4
SCHEMBL29316561 0.81 IRAK4 (0.61) IRAK4
SCHEMBL29328909 0.80 IRAK4 (0.42) IRAK4CRBN
SCHEMBL29318263 0.79 CYP2C19 (0.48) CRBNKDM4EALDH1A1DDB1CCNE2
SCHEMBL29329521 0.78 IRAK4 (0.37) IRAK4CRBNDDB1

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
EP-4400499-A1 GLUTARIMIDE COMPOUND AND USE THEREOF Medshine Discovery Inc. (CN) 2024-07-17 EP disclosed