SCHEMBL24299444

SCHEMBL24299444

CC(C)(C)OC(=O)N1CCN(c2ccc3c(c2)C(=O)N(C2CCC(=O)NC2=O)C3O)CC1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 13/20 0.54
▸ DDB1 Q16531 12/20 0.54
▸ PDK2 Q15119 1/20 0.44
▸ GPR119 Q8TDV5 5/20 0.42
▸ ALDH1A1 P00352 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL24299447 0.94 CRBN (0.55) CRBNDDB1PDK2GPR119ALDH1A1
SCHEMBL29919925 0.91 CRBN (0.47) CRBNDDB1GPR119
SCHEMBL22951134 0.91 CRBN (0.47) CRBNDDB1GPR119
SCHEMBL24481058 0.87 CRBN (0.48) CRBNDDB1PDK2GPR119
SCHEMBL20046318 0.86 CRBN (0.54) CRBNDDB1PDK2GPR119ALDH1A1
SCHEMBL20046596 0.86 CRBN (0.51) CRBNDDB1PDK2MAPT
SCHEMBL22291602 0.86 DDB1 (0.54) CRBNDDB1MAPT
SCHEMBL20046178 0.86 CRBN (0.51) CRBNDDB1PDK2MAPT
SCHEMBL22291548 0.85 CRBN (0.46) CRBNDDB1PDK2GPR119ALDH1A1
SCHEMBL22951135 0.85 CRBN (0.48) CRBNDDB1PDK2GPR119

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-2022048605-A1 HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE, COMPOSITION, AND APPLICATIONS 南昌奥瑞药业有限公司 2022-03-10 — — WO disclosed
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