SCHEMBL7642787

SCHEMBL7642787

Nc1ccn([C@]2(CO)SC[C@H](F)[C@@H]2O)c(=O)n1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDE3A Q14432 3/20 0.40
▸ LMNA P02545 3/20 0.40
▸ CACNA1F O60840 2/20 0.40
▸ ALB P02768 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ CACNA1D Q01668 2/20 0.40
▸ CACNA1S Q13698 2/20 0.40
▸ CACNA1C Q13936 2/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ SLC29A1 Q99808 1/20 0.40
▸ THRB P10828 1/20 0.37
▸ MTOR P42345 1/20 0.37
▸ MDM2 Q00987 1/20 0.37
▸ NCOA1 Q15788 1/20 0.37
▸ NCOA3 Q9Y6Q9 1/20 0.37
▸ FGFR1 P11362 2/20 0.32
▸ POLG P54098 1/20 0.31
▸ SLC22A6 Q4U2R8 1/20 0.30

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
SCHEMBL368408 0.73 PDE3A (0.42) PDE3ALMNACACNA1FALBMAPT
SCHEMBL9470349 0.71 LMNA (0.39) PDE3ALMNACACNA1FALBMAPT
SCHEMBL17453435 0.70 PDE3A (0.45) PDE3ALMNACACNA1FALBMAPT
SCHEMBL28767671 0.68 PDE3A (0.43) PDE3ALMNACACNA1FALBMAPT
SCHEMBL599849 0.68 PDE3A (0.46) PDE3ALMNACACNA1FALBMAPT
SCHEMBL599848 0.68 PDE3A (0.46) PDE3ALMNACACNA1FALBMAPT
SCHEMBL706810 0.68 PDE3A (0.41) PDE3ALMNACACNA1FALBMAPT
SCHEMBL9234666 0.68 PDE3A (0.39) PDE3ALMNACACNA1FALBMAPT
SCHEMBL28829196 0.68 PDE3A (0.49) PDE3ALMNACACNA1FALBMAPT
SCHEMBL7805953 0.68 PDE3A (0.39) PDE3ALMNACACNA1FALBMAPT

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-0841344-B1 1-(2-DEOXY-2-FLUORO-4-THIO-BETA-D-ARABINOFURANOSYL)CYTOSINES YAMASA CORP (JP) 2002-09-25 — — EP disclosed
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