SCHEMBL3858686

SCHEMBL3858686

CC=C(COCP(=O)(OC(C)C)OC(C)C)C(O[SiH2]C(C)(C)C)(c1ccccc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL3858682 0.66 ALDH1A1 (0.31) ALDH1A1L3MBTL1
SCHEMBL13715071 0.66 CYP3A4 (0.33) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL3858685 0.66 CYP3A4 (0.33) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL13714796 0.60
SCHEMBL14244434 0.59 ALDH1A1 (0.38) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL14260068 0.58 KCNN4 (0.39) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL9176001 0.57 HSD17B10 (0.40) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL4898244 0.57 ALDH1A1 (0.48) ALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL13714773 0.57 CTSA (0.31)
SCHEMBL23910519 0.57 MAPK1 (0.44) ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7579332-B2 Nucleobase phosphonate analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2009-08-25 US disclosed
US-20060252729-A1 Nucleobase phosphonate analogs for antiviral treatment GILEAD SCIENCES, INC. 2006-11-09 US disclosed
EP-1656387-A2 NUCLEOBASE PHOSPHONATE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2006-05-17 EP disclosed
US-20050059637-A1 Nucleobase phosphonate analogs for antiviral treatment GILEAD SCIENCES, INC. 2005-03-17 US disclosed
WO-2005012324-A2 NUCLEOBASE PHOSPHONATE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2005-02-10 WO 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-20060252729-A1 Nucleobase phosphonate analogs for antiviral treatment TYMP, TK1, NUDT1 ALDH1A1 2860/4885L3MBTL1 1110/4885SMN1; SMN2 890/4885
US-20050059637-A1 Nucleobase phosphonate analogs for antiviral treatment TYMP, TK1, NUDT1 ALDH1A1 2860/4885L3MBTL1 1110/4885SMN1; SMN2 890/4885

“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.