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SCHEMBL29674419

SCHEMBL29674419

CC(C)[Si]1(C(C)C)OC[C@@H]2O[C@@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)[C@H](O)[C@H]2O[Si](C(C)C)(C(C)C)O1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 2/20 0.47
▸ PDE4B Q07343 2/20 0.47
▸ PDE4C Q08493 2/20 0.47
▸ PDE4D Q08499 2/20 0.47
▸ ADORA2A P29274 2/20 0.44
▸ ADORA2B P29275 2/20 0.44
▸ P2RY12 Q9H244 1/20 0.44
▸ BMPR1B O00238 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
SCHEMBL29772235 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL10459187 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL9945534 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL3360473 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL19509816 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL22984018 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL19509705 1.00 PDE4A (0.47) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL4287258 0.92 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL9945527 0.90 P2RY12 (0.41) PDE4APDE4BPDE4CPDE4DADORA2A
SCHEMBL15892163 0.89 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DADORA2A

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
EP-4013428-A1 MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF Ionis Pharmaceuticals, Inc. (US) 2022-06-22 — — EP disclosed
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