SCHEMBL18059298

SCHEMBL18059298

C=C1[C@H](O)CC(=C/C=C2\CCC[C@@]3(C)C2CCC3[C@@H](C)OCCC(O)(CC)CC)C[C@H]1O

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 10/20 0.77

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
SCHEMBL10125228 1.00 VDR (0.77) VDR
SCHEMBL10125238 0.95 VDR (0.74) VDR
SCHEMBL4168474 0.91 VDR (0.78) VDR
SCHEMBL10125231 0.89 VDR (0.60) VDR
SCHEMBL13804831 0.86 VDR (0.91) VDR
SCHEMBL14112487 0.86 VDR (0.91) VDR
SCHEMBL10125253 0.86 VDR (0.70) VDR
SCHEMBL30956326 0.86 VDR (0.85) VDR
SCHEMBL4158067 0.85 VDR (0.69) VDR
SCHEMBL10125252 0.84 VDR (0.68) 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
EP-2419403-B1 VITAMIN D RECEPTOR AGONISTS AND USES THEREOF VIDASYM INC (US) 2016-09-07 — — EP disclosed
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