SCHEMBL30180332

SCHEMBL30180332

CCCCOC(=O)N1CCC(O)(c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 16/20 0.48
▸ DDB1 Q16531 12/20 0.48
▸ IKZF3 Q9UKT9 3/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ CHRM2 P08172 1/20 0.44
▸ OPRM1 P35372 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ SALL4 Q9UJQ4 3/20 0.43
▸ GSPT1 P15170 3/20 0.43
▸ CSNK1A1 P48729 2/20 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
SCHEMBL30180446 0.86 CRBN (0.54) CRBNDDB1IKZF3SALL4GSPT1
SCHEMBL29683622 0.84 CRBN (0.63) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL30036087 0.84 CRBN (0.55) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL27157361 0.84 CRBN (0.55) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL27157405 0.83 CRBN (0.58) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29328091 0.82 CRBN (0.55) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL30135762 0.81 CRBN (0.58) CRBNDDB1
SCHEMBL30996489 0.80 CRBN (0.57) CRBNDDB1TSHR
SCHEMBL29547374 0.80 CRBN (0.56) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL30135998 0.79 CRBN (0.65) CRBNDDB1IKZF3ALDH1A1TSHR

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
EP-4362939-A1 BIFUNCTIONAL COMPOUNDS THAT DEGRADE ALK AND USES THEREOF Dana-Farber Cancer Institute, Inc. (US) 2024-05-08 — — EP disclosed
WO-2023278325-A1 BIFUNCTIONAL COMPOUNDS THAT DEGRADE ALK AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-01-05 — — WO disclosed
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