SCHEMBL14107902

SCHEMBL14107902

COCOC(C)(C)C/C=C/[C@@H](C)C1CCC2/C(=C/C=C3C[C@@H](O[Si](C)(C)C(C)(C)C)C(=CCO)[C@H](O[Si](C)(C)C(C)(C)C)C3)CCCC21C

nearest known ligand 0.44

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 16/20 0.44

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
SCHEMBL14107901 0.91 VDR (0.43) VDR
SCHEMBL14107899 0.90 VDR (0.44) VDR
SCHEMBL14107900 0.90 VDR (0.42) VDR
SCHEMBL14107897 0.87 VDR (0.48) VDR
SCHEMBL14107895 0.86 VDR (0.44) VDR
SCHEMBL14154002 0.84 VDR (0.53) VDR
SCHEMBL12060347 0.83 VDR (0.62) VDR
SCHEMBL14107898 0.83 VDR (0.42) VDR
SCHEMBL14154003 0.80 VDR (0.49) VDR
SCHEMBL14107850 0.79 VDR (0.66) 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-7402688-B2 2,2-Di-substituted 1alpha,25-dihydroxy-19-norvitamin D derivative WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-07-22 — — US disclosed
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