SCHEMBL28908653

SCHEMBL28908653

COC(=O)C1(C(=O)O)Cc2c(C)[nH]c(=O)c(C)c2C1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 1/20 0.30
PDE3A Q14432 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
SCHEMBL23857411 0.92 PDE3B (0.33) PDE3BPDE3A
SCHEMBL23857530 0.88 KDM4E (0.33)
SCHEMBL28908745 0.86 PDE3B (0.33) PDE3BPDE3A
SCHEMBL28908720 0.86
SCHEMBL23857457 0.78 PDE3B (0.36) PDE3BPDE3A
SCHEMBL23857214 0.78 EZH2 (0.31)
SCHEMBL28908749 0.76 CYP1A2 (0.32)
SCHEMBL28908625 0.73
SCHEMBL23857418 0.72
SCHEMBL28908809 0.70 GAA (0.33)

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
CN-115298176-A Compounds and their use in the treatment of bacterial infections 豪夫迈·罗氏有限公司 2022-11-04 CN disclosed