SCHEMBL5956640

SCHEMBL5956640

C[Si](C)(C)CCOCn1ccc2c(NC(=O)c3ccc4c(c3)SCC[C@@H]4NC(=O)OCc3ccccc3)ccnc21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.34
DNMT3A Q9Y6K1 1/20 0.34
HDAC1 Q13547 5/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC3 O15379 1/20 0.34
SIRT5 Q9NXA8 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
AURKA O14965 1/20 0.33
FLT1 P17948 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.33
DGAT1 O75907 2/20 0.33
PLAU P00749 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL5956643 1.00 DNMT1 (0.34) DNMT1DNMT3AHDAC1HDAC2HDAC3
SCHEMBL5956625 0.88 DNMT1 (0.38) DNMT1DNMT3AHDAC1HDAC2HDAC3
SCHEMBL5956632 0.88 DNMT1 (0.38) DNMT1DNMT3AHDAC1HDAC2HDAC3
SCHEMBL5956780 0.87 DNMT1 (0.33) DNMT1DNMT3AHDAC1HDAC2HDAC3
SCHEMBL5956781 0.81 DGAT1 (0.32) DNMT1DNMT3ADGAT1
SCHEMBL5956742 0.79 IRAK4 (0.32) DGAT1
SCHEMBL5956589 0.78 JAK2 (0.45) DNMT1DNMT3ASIRT5SMN1; SMN2
SCHEMBL5956584 0.78 JAK2 (0.45) DNMT1DNMT3ASIRT5SMN1; SMN2
SCHEMBL5956731 0.78 DGAT1 (0.33) AURKAFLT1KDRFLT3DGAT1
SCHEMBL5956725 0.74 POLB (0.51) DNMT1DNMT3A

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-1270570-B1 AMIDE COMPOUNDS AND USE THEREOF MITSUBISHI PHARMA CORP (JP) 2006-05-31 EP disclosed
US-6933305-B2 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2005-08-23 US disclosed
US-20030158413-A1 Amide compounds and use thereof MITSUBISHI PHARMA CORPORATION (JP) 2003-08-21 US disclosed
EP-1270570-A1 AMIDE COMPOUNDS AND USE THEREOF Mitsubishi Pharma Corporation (JP) 2003-01-02 EP 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-20030158413-A1 Amide compounds and use thereof ROCK2, ROCK1, RHOT2 DNMT1 4188/4885DNMT3A 3905/4885HDAC1 780/4885

“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.