SCHEMBL21581235

SCHEMBL21581235

NCCCCCCNc1nc2c(N)ncnc2n1C1OC2COP(=O)(O)OC2C1O

nearest known ligand 0.71

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 20/20 0.71
▸ PDE4B Q07343 20/20 0.71
▸ PDE4C Q08493 20/20 0.71
▸ PDE4D Q08499 20/20 0.71
▸ PRKACA P17612 1/20 0.58
▸ PRKACG P22612 1/20 0.58
▸ PRKACB P22694 1/20 0.58

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
SCHEMBL29829593 1.00 PDE4A (0.71) PDE4APDE4BPDE4CPDE4DPRKACA
SCHEMBL5151085 0.91 MEN1 (0.58) PDE4APDE4BPDE4CPDE4D
SCHEMBL9702440 0.84 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPRKACA
SCHEMBL5154471 0.84 MEN1 (0.61) PDE4APDE4BPDE4CPDE4DPRKACA
SCHEMBL5151089 0.83 PDE4A (0.59) PDE4APDE4BPDE4CPDE4D
SCHEMBL15626122 0.81 FBP1 (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL14261298 0.80 PDE4A (0.82) PDE4APDE4BPDE4CPDE4DPRKACA
SCHEMBL9505216 0.80 PDE4A (0.82) PDE4APDE4BPDE4CPDE4DPRKACA
SCHEMBL5951342 0.80 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPRKACA
Tocladesine SCHEMBL1651488 0.80 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DPRKACA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3575791-B1 BLOOD TREATMENT METHOD AND BLOOD COLLECTION TUBE ARKRAY INC (JP) 2024-01-10 — — EP disclosed
CN-110547288-B Blood processing method and blood collection tube 爱科来株式会社 2022-09-02 — — CN disclosed
CN-110547288-A Blood processing method and blood collection tube ARKRAY INC 2019-12-10 — — CN disclosed
EP-3575791-A1 BLOOD TREATMENT METHOD AND BLOOD COLLECTION TUBE ARKRAY, Inc. (JP) 2019-12-04 — — EP disclosed
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