SCHEMBL6922776

SCHEMBL6922776

CN(C(=O)Oc1cccc([Si](C)(C)CN2CCNCC2)c1)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ACHE P22303 6/20 0.36
ESRRG P62508 2/20 0.35
BCHE P06276 4/20 0.35
MAOB P27338 1/20 0.35
LMNA P02545 2/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
FAAH O00519 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
SCHEMBL14590400 0.77 BRD4 (0.41) ALDH1A1KDM4EESRRGMEN1KMT2A
SCHEMBL5341329 0.77 HSP90AA1 (0.39) ALDH1A1KDM4EESRRGMEN1KMT2A
SCHEMBL6922780 0.71 ESRRG (0.35) ALDH1A1KDM4EESRRG
SCHEMBL6922783 0.71 ESRRG (0.37) ALDH1A1KDM4EESRRG
SCHEMBL8523247 0.69 ACHE (0.55) ACHEBCHELMNAMEN1KMT2A
SCHEMBL434849 0.68 ESRRG (0.55) ESRRGLMNA
SCHEMBL5355641 0.66 NCEH1 (0.49) ALDH1A1KDM4EACHEBCHELMNA
SCHEMBL27389053 0.65 L3MBTL1 (0.53) ALDH1A1KDM4EACHEBCHELMNA
SCHEMBL5340820 0.65 ESRRG (0.38) ESRRGLMNA
SCHEMBL14590407 0.63 BRD4 (0.38) KDM4EMEN1KMT2ASMN1; SMN2FAAH

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-6740712-B2 SILICON LINKERS BASED ON CARBAMYL PIPERAZINE MOIETY; USE IN SOLID PHASE SYNTHESIS OF COMPOUNDS OR LIBRARIES OF COMPOUNDS EMBRACING A PHENYL RING IN THEIR STRUCTURE BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-05-25 US disclosed
US-20020120072-A1 Polymers based on N-carbamyl-N'-dimethysilyl methyl-piperazine traceless linkers for the solid phase synthesis of phenyl based libraries BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-08-29 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-20020120072-A1 Polymers based on N-carbamyl-N'-dimethysilyl methyl-piperazine traceless linkers for the solid phase synthesis of phenyl based libraries DOT1L, DNMT3L, SMYD2 ALDH1A1 3153/4885KDM4E 146/4885ACHE 2897/4885

“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.