SCHEMBL5340820

SCHEMBL5340820

C[Si](C)(CN1CCNCC1)c1cccc(C2OCCO2)c1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESRRG P62508 2/20 0.38
SOS1 Q07889 1/20 0.33
CXCR4 P61073 4/20 0.32
SIGMAR1 Q99720 1/20 0.32
DRD3 P35462 3/20 0.32
MGAM O43451 1/20 0.32
LMNA P02545 1/20 0.31
BRD4 O60885 1/20 0.31

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
SCHEMBL14590406 0.79 HTT (0.41) BRD4
SCHEMBL434849 0.76 ESRRG (0.55) ESRRGSIGMAR1MGAMLMNA
SCHEMBL5346670 0.75 ALDH1A1 (0.34) LMNA
SCHEMBL24215776 0.71 HTR7 (0.53) SIGMAR1DRD3
SCHEMBL5341329 0.70 HSP90AA1 (0.39) ESRRGSOS1
SCHEMBL28961627 0.68 MEN1 (0.33) DRD3LMNA
SCHEMBL9989007 0.67 ALDH1A1 (0.36) DRD3LMNA
SCHEMBL6922776 0.65 ALDH1A1 (0.38) ESRRGLMNA
SCHEMBL31468540 0.62 CXCR4 (0.43) CXCR4
SCHEMBL194639 0.62 KDM1A (0.50) DRD3

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-7164018-B2 Polymers based on N-carbamyl-N'-dimethylsilyl methyl-piperazine traceless linkers for the solid phase synthesis of phenyl based libraries BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-01-16 US disclosed
US-7164018-B2 Polymers based on N-carbamyl-N'-dimethylsilyl methyl-piperazine traceless linkers for the solid phase synthesis of phenyl based libraries BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-01-16 US disclosed
US-20040186243-A1 Polymers based on N-carbamyl-N'-dimethylsilyl methyl-piperazine traceless linkers for the solid phase synthesis of phenyl based libraries BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-09-23 US disclosed
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 ESRRG 4148/4885SOS1 1557/4885CXCR4 4085/4885

“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.