SCHEMBL19288068

SCHEMBL19288068

C=C1C(O)C/C(=C\C=C2/CCCC3(C)C2CCC3[C@H](C)CCC(C)C(C)(C)O)C[C@H]1O

nearest known ligand 0.81

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 5/20 0.77
▸ CYP24A1 Q07973 1/20 0.70

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
SCHEMBL13759523 0.93 VDR (0.75) VDRCYP24A1
SCHEMBL4156343 0.90 VDR (0.79) VDR
Dp001 SCHEMBL15371114 0.90 VDR (0.81) VDR
Dp001 SCHEMBL19988220 0.90 VDR (0.81) VDR
Dp001 SCHEMBL12932256 0.90 VDR (0.81) VDR
Dp001 SCHEMBL18470321 0.90 VDR (0.81) VDR
Dp001 SCHEMBL10307542 0.90 VDR (0.81) VDR
Dp001 SCHEMBL15371106 0.90 VDR (0.81) VDR
Dp001 SCHEMBL21206294 0.90 VDR (0.81) VDR
Dp001 SCHEMBL8303273 0.90 VDR (0.81) 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-2855429-B1 CRYSTALLIZATION OF (20R)-2-METHYLENE-19-NOR-24-DIFLUORO-1alpha , 25-DIHYDROXYVITAMIN D3 WISCONSIN ALUMNI RES FOUND (US) 2017-08-30 — — EP disclosed
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