SCHEMBL5670864

SCHEMBL5670864

CCC[C@@H]1C[C@@]1(CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)OCP(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.43
HTT P42858 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
SMYD2 Q9NRG4 3/20 0.34
TP53 P04637 2/20 0.31
MAPT P10636 2/20 0.31
TSHR P16473 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
LMNA P02545 1/20 0.30
MAPK1 P28482 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL5670862 1.00 CYP3A4 (0.43) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL6053775 0.92 CYP3A4 (0.41) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL6053776 0.92 CYP3A4 (0.41) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL6053703 0.86 CYP3A4 (0.40) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL2914122 0.86 CYP3A4 (0.40) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL6053844 0.86 CYP3A4 (0.40) CYP3A4HTTSMN1; SMN2SMYD2
SCHEMBL4273007 0.78 CYP3A4 (0.38) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL2913457 0.77 CYP3A4 (0.37) CYP3A4HTTSMN1; SMN2SMYD2TP53
SCHEMBL9655148 0.74 HTT (0.40) CYP3A4HTTSMN1; SMN2SMYD2TSHR
SCHEMBL13328628 0.72 CYP3A4 (0.40) CYP3A4HTTSMN1; SMN2SMYD2

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
EP-1546164-A4 (+)-TRANS-ISOMERS OF (1-PHOSPHONOMETHOXY-2-ALKYLCYCLOPROPYL) METHYL NUCLEOSIDE DERIVATIVES, PROCESS FOR THE PREPARATION OF STEREOISOMERS THEREOF, AND USE OF ANTIVIRAL AGENTS THEREOF LG LIFE SCIENCES LTD (KR) 2006-06-07 EP disclosed
US-20060111324-A1 (+)-Ttrans-isomers of (1-phosphonomethoxy-2-alkylcyclopropyl)methyl nucleoside derivatives, process for the preparation of stereoisomers thereof, and use of antiviral agents thereof LG LIFE SCIENCES (KR) 2006-05-25 US disclosed
EP-1546164-A1 (+)-TRANS-ISOMERS OF (1-PHOSPHONOMETHOXY-2-ALKYLCYCLOPROPYL) METHYL NUCLEOSIDE DERIVATIVES, PROCESS FOR THE PREPARATION OF STEREOISOMERS THEREOF, AND USE OF ANTIVIRAL AGENTS THEREOF LG Life Sciences Ltd. (KR) 2005-06-29 EP disclosed
WO-2004029064-A1 (+)-TRANS-ISOMERS OF (1-PHOSPHONOMETHOXY-2-ALKYLCYCLOPROPYL) METHYL NUCLEOSIDE DERIVATIVES, PROCESS FOR THE PREPARATION OF STEREOISOMERS THEREOF, AND USE OF ANTIVIRAL AGENTS THEREOF LG LIFE SCIENCES LTD. (KR) 2004-04-08 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 (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-20060111324-A1 (+)-Ttrans-isomers of (1-phosphonomethoxy-2-alkylcyclopropyl)methyl nucleoside derivatives, process for the preparation of stereoisomers thereof, and use of antiviral agents thereof TTR, HAVCR2, PNP CYP3A4 580/4885HTT 1430/4885SMN1; SMN2 358/4885

“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.