SCHEMBL26088698

SCHEMBL26088698

CC[Si](CC)(CC)OC(C)(C)CCC(F)C(C)[C@H]1CC[C@H]2C(=O)CCC[C@]12C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 7/20 0.35
▸ CDC25A P30304 1/20 0.32
▸ CDC25B P30305 1/20 0.32
▸ CYP19A1 P11511 2/20 0.32

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
SCHEMBL26091642 1.00 VDR (0.35) VDRCDC25ACDC25BCYP19A1
SCHEMBL26088692 1.00 VDR (0.35) VDRCDC25ACDC25BCYP19A1
SCHEMBL10070738 0.90 VDR (0.35) VDRCDC25ACDC25BCYP19A1
SCHEMBL10070741 0.90 VDR (0.35) VDRCDC25ACDC25BCYP19A1
SCHEMBL10070742 0.90 VDR (0.35) VDRCDC25ACDC25BCYP19A1
SCHEMBL10070737 0.90 VDR (0.35) VDRCDC25ACDC25BCYP19A1
SCHEMBL26088801 0.84 VDR (0.41) VDR
SCHEMBL26091902 0.84 VDR (0.41) VDR
SCHEMBL26088798 0.84 VDR (0.41) VDR
SCHEMBL26088804 0.84 VDR (0.41) 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
WO-2023068322-A1 CD RING SIDE CHAIN-SUBSTITUTED VITAMIN D DERIVATIVE 学校法人帝京大学 2023-04-27 — — WO disclosed
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