SCHEMBL30984857

SCHEMBL30984857

Nc1ccc(N2CCC3(CCN(CCC4CCN(c5ccc6c(c5)C(=O)N(C5CCC(=O)NC5=O)C6=O)CC4)CC3)CC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 18/20 0.60
▸ DDB1 Q16531 8/20 0.55
▸ BTK Q06187 1/20 0.47
▸ AR P10275 1/20 0.46
▸ HPGDS O60760 1/20 0.46
▸ ITK Q08881 2/20 0.46
▸ IL2 P60568 1/20 0.46
▸ CCNC P24863 1/20 0.46
▸ CDK8 P49336 1/20 0.46
▸ IRAK1 P51617 1/20 0.46
▸ NTRK3 Q16288 1/20 0.46
▸ HASPIN Q8TF76 1/20 0.46
▸ CDK19 Q9BWU1 1/20 0.46
▸ IRAK4 Q9NWZ3 1/20 0.46
▸ IRAK3 Q9Y616 1/20 0.46
▸ ESR1 P03372 2/20 0.45
▸ ALDH1A1 P00352 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ IKZF3 Q9UKT9 1/20 0.43

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
SCHEMBL30984978 0.92 CRBN (0.62) CRBNDDB1BTKARITK
SCHEMBL30984807 0.89 CRBN (0.58) CRBNDDB1BTKARHPGDS
SCHEMBL30985045 0.86 CRBN (0.57) CRBNESR1
SCHEMBL30984840 0.86 CRBN (0.57) CRBNESR1
SCHEMBL30985040 0.85 CRBN (0.65) CRBNDDB1BTKARHPGDS
SCHEMBL30985055 0.85 CRBN (0.65) CRBNDDB1BTKARHPGDS
SCHEMBL22291391 0.85 CRBN (0.67) CRBNDDB1ARHPGDSITK
SCHEMBL31628425 0.84 CRBN (0.64) CRBNDDB1BTKARHPGDS
SCHEMBL24299348 0.84 CRBN (0.66) CRBNDDB1BTKARIRAK1
SCHEMBL29986989 0.84 CRBN (0.66) CRBNDDB1BTKARIRAK1

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-2024146502-A1 WEE1 DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-07-11 — — WO disclosed
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