SCHEMBL18040837

SCHEMBL18040837

CCC(O)(CC)CCCO[C@H](C)C1CCC2C(=CC=C3C[C@@H](O[Si](C)(C)C(C)(C)C)C4(CC4)[C@H](O[Si](C)(C)C(C)(C)C)C3)CCCC21C

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 16/20 0.58

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
SCHEMBL10125394 1.00 VDR (0.58) VDR
SCHEMBL10152624 0.90 VDR (0.59) VDR
SCHEMBL10125489 0.89 VDR (0.51) VDR
SCHEMBL10125470 0.89 VDR (0.61) VDR
SCHEMBL10125389 0.87 VDR (0.47) VDR
SCHEMBL10125230 0.86 VDR (0.66) VDR
SCHEMBL13089997 0.85 VDR (0.52) VDR
SCHEMBL18059310 0.85 VDR (0.47) VDR
SCHEMBL10125238 0.82 VDR (0.74) VDR
SCHEMBL10125504 0.82 VDR (0.57) 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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