SCHEMBL14469841

SCHEMBL14469841

CC[Si](CC)(CC)OC(C)(C)CCC[C@@H](C)C1CCC2/C(=C/C=C3\C[C@@H](CC(C)(C)[Si](C)(C)O)/C(=C/CCOCOC)[C@H](O[Si](C)(C)C(C)(C)C)C3)CCC[C@@]21C

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 11/20 0.59

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
SCHEMBL13843811 0.92 VDR (0.48) VDR
SCHEMBL9070758 0.92 VDR (0.48) VDR
SCHEMBL9010772 0.85 VDR (0.71) VDR
SCHEMBL9070759 0.82 VDR (0.36) VDR
SCHEMBL822900 0.82 VDR (0.47) VDR
SCHEMBL823016 0.82 VDR (0.47) VDR
SCHEMBL13637004 0.81 VDR (0.46) VDR
SCHEMBL13637005 0.81 VDR (0.46) VDR
SCHEMBL19391880 0.79 VDR (0.46) VDR
SCHEMBL19391876 0.79 VDR (0.46) VDR

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
US-7241747-B2 2-propylidene-19-nor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-07-10 — — US disclosed
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