SCHEMBL8529609

SCHEMBL8529609

C=C(C=O)[C@@H]1CC[C@@H]2[C@H](OCOC)CCC[C@]21C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 1/20 0.32
CDC25B P30305 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
SCHEMBL8995737 1.00 CDC25A (0.32) CDC25ACDC25B
SCHEMBL8995734 1.00 CDC25A (0.32) CDC25ACDC25B
SCHEMBL8526726 0.82 SRD5A2 (0.30)
SCHEMBL8529059 0.82 CDC25A (0.31) CDC25ACDC25B
SCHEMBL8995585 0.82 GRIN2D (0.39)
SCHEMBL8529022 0.73 CDC25A (0.41) CDC25ACDC25B
SCHEMBL11227965 0.66 CYP19A1 (0.49)
SCHEMBL10125292 0.65 GABRP (0.43)
SCHEMBL9009451 0.61 MEN1 (0.47)
SCHEMBL9009430 0.61 MEN1 (0.47)

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-0663902-B1 25-CARBOXYLIC ACID DERIVATIVES IN THE VITAMIN D SERIES, PHARMACEUTICAL PREPARATIONS CONTAINING THESE DERIVATIVES AND THEIR USE IN THE MANUFACTURE OF MEDICINES SCHERING AG (DE) 1998-03-11 EP disclosed