SCHEMBL13993777

SCHEMBL13993777

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

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ VDR P11473 10/20 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
SCHEMBL13804812 0.91 VDR (0.59) VDR
SCHEMBL13993787 0.91 VDR (0.59) VDR
SCHEMBL13804827 0.91 VDR (0.59) VDR
SCHEMBL14356235 0.90 VDR (0.63) VDR
SCHEMBL26322428 0.87 VDR (0.68) VDR
SCHEMBL26322425 0.86 VDR (0.59) VDR
SCHEMBL26324018 0.85 VDR (0.57) VDR
SCHEMBL13993785 0.83 VDR (0.54) VDR
SCHEMBL5069262 0.82 VDR (0.52) VDR
SCHEMBL22679443 0.82 VDR (0.52) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7468361-B2 2-ethyl and 2-ethylidene-19-nor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-12-23 — — US disclosed
US-20080032956-A1 2-Ethyl and 2-Ethylidene-19-Nor-Vitamin D Compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2008-02-07 — — US disclosed
US-7300925-B2 2-ethyl and 2-ethylidene-19-nor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-11-27 — — US disclosed
US-20070088008-A1 2-Ethyl and 2-ethylidene-19-nor-vitamin D compounds WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2007-04-19 — — 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 (2 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-20080032956-A1 2-Ethyl and 2-Ethylidene-19-Nor-Vitamin D Compounds CYP24A1, VDR, CYP2R1 VDR 2/4885
US-20070088008-A1 2-Ethyl and 2-ethylidene-19-nor-vitamin D compounds CYP24A1, VDR, CYP2R1 VDR 2/4885

“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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