SCHEMBL23565610

SCHEMBL23565610

O=C1CCC(N2Cc3ccc(-c4ccccc4I)cc3C2=O)C(=O)N1

nearest known ligand 0.70

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 18/20 0.70
▸ DDB1 Q16531 2/20 0.53
▸ IKZF3 Q9UKT9 2/20 0.53
▸ BRD4 O60885 1/20 0.53
▸ TNF P01375 1/20 0.53
▸ IL1B P01584 1/20 0.53
▸ IKZF1 Q13422 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.51
▸ CHRM2 P08172 1/20 0.51
▸ OPRM1 P35372 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ TSHR P16473 1/20 0.51
▸ TDP1 Q9NUW8 1/20 0.51
▸ CSNK1A1 P48729 1/20 0.51
▸ MAP1LC3B Q9GZQ8 1/20 0.51

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
SCHEMBL23534326 0.87 CRBN (0.71) CRBNDDB1IKZF3BRD4TNF
SCHEMBL29791157 0.87 CRBN (0.71) CRBNDDB1IKZF3BRD4TNF
SCHEMBL23565612 0.85 CRBN (0.69) CRBN
SCHEMBL23565611 0.84 CRBN (0.65) CRBNDDB1IKZF3BRD4TNF
SCHEMBL19556665 0.83 CRBN (1.00) CRBNDDB1IKZF3BRD4TNF
SCHEMBL19556664 0.83 CRBN (1.00) CRBNDDB1IKZF3BRD4TNF
SCHEMBL27097754 0.83 CRBN (1.00) CRBNDDB1IKZF3BRD4TNF
SCHEMBL476917 0.83 CRBN (1.00) CRBNDDB1IKZF3BRD4TNF
SCHEMBL24186805 0.82 CRBN (0.75) CRBN
SCHEMBL23564835 0.82 CRBN (0.66) CRBNDDB1IKZF3BRD4TNF

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-2021126974-A1 BIFUNCTIONAL AGENTS FOR PROTEIN RECRUITMENT AND/OR DEGRADATION ORIONIS BIOSCIENCES, INC. (US) 2021-06-24 — — WO disclosed
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