SCHEMBL22557583

SCHEMBL22557583

CC(C)(CN1CCC2(CC1)CN(c1ccc3c(=O)n(C4CCC(=O)NC4=O)cnc3c1)C2)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 17/20 0.41
▸ DDB1 Q16531 11/20 0.41
▸ IKZF3 Q9UKT9 4/20 0.41
▸ USP7 Q93009 1/20 0.35
▸ ESR1 P03372 4/20 0.33
▸ HTR4 Q13639 1/20 0.31
▸ TLR8 Q9NR97 1/20 0.31
▸ TLR7 Q9NYK1 1/20 0.31

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
SCHEMBL22556796 0.84 DDB1 (0.44) CRBNDDB1IKZF3
SCHEMBL22557788 0.81 CRBN (0.49) CRBNDDB1IKZF3
SCHEMBL3654403 0.73 CRBN (0.57) CRBNDDB1IKZF3
SCHEMBL24132069 0.72 CRBN (0.54) CRBNDDB1IKZF3
SCHEMBL31554634 0.70 DDB1 (0.49) CRBNDDB1IKZF3
SCHEMBL19586175 0.69 CRBN (0.76) CRBNDDB1IKZF3
SCHEMBL3655337 0.69 CRBN (0.57) CRBNDDB1IKZF3
SCHEMBL30900754 0.69 CRBN (0.49) CRBNDDB1IKZF3
SCHEMBL27239115 0.69 CRBN (0.49) CRBNDDB1IKZF3
SCHEMBL16221485 0.68 CRBN (0.56) CRBNDDB1IKZF3

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-2020211822-A1 A CLASS OF BIFUNCTIONAL CHIMERIC HETEROCYCLIC COMPOUNDS FOR TARGETED DEGRADATION OF ANDROGEN RECEPTORS AND USE THEREOF 成都海创药业有限公司 2020-10-22 — — WO disclosed
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