SCHEMBL23138087

SCHEMBL23138087

CC(C)(C)OC(=O)N1CCC(CN2CCc3cc4c(cc3CC2)C(=O)N(C2CCC(=O)NC2=O)C4=O)CC1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 18/20 0.56
▸ DDB1 Q16531 10/20 0.50
▸ AR P10275 1/20 0.45
▸ BRD9 Q9H8M2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ OPRM1 P35372 1/20 0.42
▸ IKZF3 Q9UKT9 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL23044632 0.90 CRBN (0.66) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29760449 0.90 CRBN (0.66) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29927733 0.87 CRBN (0.59) CRBNDDB1AR
SCHEMBL29802963 0.87 CRBN (0.58) CRBNDDB1AR
SCHEMBL20234891 0.87 CRBN (0.58) CRBNDDB1AR
SCHEMBL30830961 0.87 CRBN (0.52) CRBNDDB1AR
SCHEMBL29132140 0.87 CRBN (0.59) CRBNDDB1AR
SCHEMBL25035423 0.87 CRBN (0.61) CRBNDDB1ARIKZF3
SCHEMBL29927426 0.86 CRBN (0.58) CRBNDDB1AR
SCHEMBL29132100 0.86 CRBN (0.58) CRBNDDB1AR

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-2021055756-A1 SPIROCYCLIC ANDROGEN RECEPTOR PROTEIN DEGRADERS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2021-03-25 — — WO disclosed
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