SCHEMBL30741738

SCHEMBL30741738

CC(C)(C)OC(=O)N1CCN(C#Cc2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3=O)CC1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.53
▸ DDB1 Q16531 16/20 0.53
▸ ALDH1A1 P00352 1/20 0.46
▸ CHRM2 P08172 1/20 0.46
▸ OPRM1 P35372 1/20 0.46
▸ IKZF3 Q9UKT9 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL30741698 1.00 CRBN (0.53) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30738814 0.88 CRBN (0.53) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL27178948 0.88 CRBN (0.53) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL30741758 0.87 CRBN (0.53) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL28535858 0.85 CRBN (0.54) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL21906689 0.85 CRBN (0.53) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL23729736 0.84 CRBN (0.51) CRBNDDB1
SCHEMBL22297514 0.84 CRBN (0.67) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20046281 0.84 CRBN (0.67) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29629059 0.84 CRBN (0.67) CRBNDDB1ALDH1A1CHRM2OPRM1

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
CN-119233974-A Indolone derivative and application thereof 康百达(四川)生物医药科技有限公司 2024-12-31 — — CN disclosed
WO-2024017372-A1 INDOLONE DERIVATIVE AND USE THEREOF 成都百裕制药股份有限公司 2024-01-25 — — WO disclosed
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