SCHEMBL20230475

SCHEMBL20230475

CN(C)/C=N/c1nc2c(ncn2[C@H]2C[C@H]3CC[C@@H](O)C3O2)c(=O)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLA1 P09884 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ PDE5A O76074 1/20 0.36
▸ PDE4A P27815 1/20 0.36
▸ PDE4B Q07343 1/20 0.36
▸ PDE4C Q08493 1/20 0.36
▸ PDE4D Q08499 1/20 0.36
▸ STING1 Q86WV6 7/20 0.35
▸ PDE3B Q13370 1/20 0.35
▸ PDE3A Q14432 1/20 0.35
▸ HPGD P15428 1/20 0.34
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ALB P02768 1/20 0.33
▸ MAPK1 P28482 1/20 0.33

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
SCHEMBL20217092 1.00 POLA1 (0.38) POLA1POLBPDE5APDE4APDE4B
SCHEMBL21564172 1.00 POLA1 (0.38) POLA1POLBPDE5APDE4APDE4B
SCHEMBL20230410 1.00 POLA1 (0.38) POLA1POLBPDE5APDE4APDE4B
SCHEMBL20217039 1.00 POLA1 (0.38) POLA1POLBPDE5APDE4APDE4B
SCHEMBL20230417 1.00 POLA1 (0.38) POLA1POLBPDE5APDE4APDE4B
SCHEMBL20217041 1.00 POLA1 (0.38) POLA1POLBPDE5APDE4APDE4B
SCHEMBL20217025 0.91 PDE5A (0.36) POLA1POLBPDE5APDE4APDE4B
SCHEMBL20217065 0.91 PDE5A (0.38) POLA1POLBPDE5APDE4APDE4B
SCHEMBL20217096 0.90 PDE5A (0.36) POLA1POLBPDE5APDE4APDE4B
SCHEMBL26455346 0.86 POLA1 (0.37) POLA1POLBPDE5APDE4APDE4B

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-2018099946-A1 NOVEL BICYCLIC NUCLEOSIDES AND OLIGOMERS PREPARED THEREFROM Universität Bern (CH) 2018-06-07 — — WO disclosed
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