SCHEMBL6749218

SCHEMBL6749218

C[C@H](CCCCC(=O)OC(C)(C)C)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
AAK1 Q2M2I8 1/20 0.34
NPSR1 Q6W5P4 5/20 0.33
ALDH1A1 P00352 4/20 0.33
MAPT P10636 4/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
RECQL P46063 2/20 0.33
PTPRC P08575 1/20 0.33
POLB P06746 2/20 0.33
P2RY12 Q9H244 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL4527172 1.00 CTSK (0.35) CTSKL3MBTL1AAK1NPSR1ALDH1A1
SCHEMBL17006101 0.83 TBXAS1 (0.37) ALDH1A1MAPT
SCHEMBL31644586 0.83 CYP3A4 (0.42) ALDH1A1POLB
SCHEMBL17019233 0.83 CYP3A4 (0.42) ALDH1A1POLB
SCHEMBL19331709 0.80 TRPA1 (0.34) NPSR1ALDH1A1
SCHEMBL17006157 0.80 TRPA1 (0.34) NPSR1ALDH1A1
SCHEMBL8892070 0.80 FFAR1 (0.37) ALDH1A1
SCHEMBL17006154 0.80 TRPA1 (0.34) NPSR1ALDH1A1
SCHEMBL14315531 0.80 SMYD2 (0.35) L3MBTL1ALDH1A1KDM4E
SCHEMBL4455719 0.79 TRPA1 (0.35) NPSR1ALDH1A1

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-8183246-B2 Acyclically substituted furopyrimidine derivatives and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-05-22 US disclosed
US-20090318475-A1 Novel, Acyclically Substituted Furopyrimidine Derivatives and Use Thereof BAYER HEALTHCARE AG (DE) 2009-12-24 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-20090318475-A1 Novel, Acyclically Substituted Furopyrimidine Derivatives and Use Thereof DPYD, PNPO, TPMT CTSK 2258/4885L3MBTL1 2842/4885AAK1 2254/4885

“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.