SCHEMBL9010871

SCHEMBL9010871

C[C@@H](CCCC(C)(C)C)[C@H]1CC[C@H]2/C(=C/C=C3C[C@@H](O)C(=CCCO)[C@H](O)C3)CCC[C@]12C

nearest known ligand 0.89

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
VDR P11473 12/20 0.89

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
SCHEMBL9010877 1.00 VDR (0.89) VDR
SCHEMBL5983382 0.94 VDR (1.00) VDR
SCHEMBL5983246 0.94 VDR (1.00) VDR
SCHEMBL5982347 0.94 VDR (1.00) VDR
SCHEMBL9009945 0.94 VDR (1.00) VDR
SCHEMBL9009943 0.94 VDR (1.00) VDR
SCHEMBL9010884 0.88 VDR (0.91) VDR
SCHEMBL817087 0.87 VDR (0.76) VDR
SCHEMBL817681 0.87 VDR (0.76) VDR
SCHEMBL14107800 0.87 VDR (0.87) 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-8188064-B2 Reducing cell differentiation of adipocyte; reducing body fat WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-05-29 US disclosed