SCHEMBL10125246

SCHEMBL10125246

CCC(CC)CCO[C@H](C)[C@H]1CCC2/C(=C/C=C3C[C@@H](O)C4(CC4)[C@H](O)C3)CCCC21C

nearest known ligand 0.54

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 12/20 0.54

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
SCHEMBL10125605 1.00 VDR (0.54) VDR
SCHEMBL18059315 1.00 VDR (0.54) VDR
SCHEMBL10125248 0.95 VDR (0.53) VDR
SCHEMBL10125611 0.95 VDR (0.53) VDR
SCHEMBL10125250 0.92 VDR (0.56) VDR
SCHEMBL10125253 0.88 VDR (0.70) VDR
SCHEMBL10125237 0.86 VDR (0.59) VDR
SCHEMBL10125231 0.86 VDR (0.60) VDR
SCHEMBL10125493 0.85 VDR (0.68) VDR
SCHEMBL10125230 0.84 VDR (0.66) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120115824-A1 Vitamin D Receptor Agonists and Uses Thereof VIDASYM, LLC (US) 2012-05-10 — — US disclosed
US-20120115824-A1 Vitamin D Receptor Agonists and Uses Thereof VIDASYM, LLC (US) 2012-05-10 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120115824-A1 Vitamin D Receptor Agonists and Uses Thereof VDR, CYP2R1, CYP24A1 VDR 1/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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