SCHEMBL28881292

SCHEMBL28881292

O=C1CCC(N2Cc3cc(CNC(=O)Nc4ccc(C(=O)O)cc4)ccc3C2=O)C(=O)N1

nearest known ligand 0.73

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 12/20 0.73
DDB1 Q16531 3/20 0.73
GSPT1 P15170 3/20 0.73
IKZF3 Q9UKT9 1/20 0.73
CSNK1A1 P48729 5/20 0.62
CYP2C19 P33261 1/20 0.60
KCNH2 Q12809 1/20 0.60
IKZF2 Q9UKS7 11/20 0.54

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
SCHEMBL31434511 0.93 CRBN (0.65) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL29285298 0.93 CRBN (0.79) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL23883030 0.92 CRBN (0.75) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL68744 0.92 CRBN (0.74) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL28881329 0.91 CRBN (0.73) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL60871 0.91 CRBN (0.76) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL2365313 0.90 CRBN (0.72) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL1413606 0.90 CRBN (0.80) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL60892 0.90 CRBN (0.77) CRBNDDB1GSPT1IKZF3CSNK1A1
SCHEMBL61785 0.90 CRBN (0.75) CRBNDDB1GSPT1IKZF3CSNK1A1

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-115304606-B Degradation agent for simultaneously targeting BTK and GSPT proteins 清华大学 2024-04-19 CN disclosed
CN-115304606-A Degradation agent for simultaneously targeting BTK and GSPT1 proteins 清华大学 2022-11-08 CN disclosed