SCHEMBL20217065

SCHEMBL20217065

C[C@@H]1CC[C@@H]2C[C@@H](n3cnc4c(=O)[nH]c(/N=C\N(C)C)nc43)O[C@@H]21

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 1/20 0.38
▸ PDE4A P27815 1/20 0.38
▸ PDE4B Q07343 1/20 0.38
▸ PDE4C Q08493 1/20 0.38
▸ PDE4D Q08499 1/20 0.38
▸ STING1 Q86WV6 7/20 0.35
▸ POLA1 P09884 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ PDE3B Q13370 1/20 0.33
▸ PDE3A Q14432 1/20 0.33
▸ IMPDH2 P12268 2/20 0.33
▸ FUT5 Q11128 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ IMPDH1 P20839 1/20 0.32

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
SCHEMBL21564172 0.91 POLA1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20217025 0.91 PDE5A (0.36) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20230475 0.91 POLA1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20217092 0.91 POLA1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20217039 0.91 POLA1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20217041 0.91 POLA1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20230410 0.91 POLA1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20230417 0.91 POLA1 (0.38) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL20217096 0.90 PDE5A (0.36) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL26455346 0.86 POLA1 (0.37) PDE5APDE4APDE4BPDE4CPDE4D

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-3330276-A1 NOVEL BICYCLIC NUCLEOSIDES AND OLIGOMERS PREPARED THEREFROM Universität Bern (CH) 2018-06-06 — — EP disclosed
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