SCHEMBL21789060

SCHEMBL21789060

COC(=O)C12CC(C1)[C@H](CO[Si](C)(C)C(C)(C)C)C2

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.31
TOP2A P11388 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
SCHEMBL21789031 0.85 TOP2A (0.33) HSD11B1TOP2A
SCHEMBL21788880 0.77 TOP2A (0.40) HSD11B1TOP2A
SCHEMBL30354018 0.75 MAPT (0.30)
SCHEMBL23161288 0.72 SCN9A (0.32)
SCHEMBL26938720 0.72 ALDH1A1 (0.32) HSD11B1
SCHEMBL20971974 0.71
SCHEMBL1809028 0.70 FKBP1A (0.35)
SCHEMBL25568333 0.69 MAPT (0.31)
SCHEMBL25568332 0.69 MAPT (0.31)
SCHEMBL15569884 0.69 FKBP1A (0.34)

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-2020047447-A1 CARDIAC SARCOMERE INHIBITORS CYTOKINETICS, INC. (US) 2020-03-05 WO disclosed