SCHEMBL301734

SCHEMBL301734

CCO[Si]1(C)CCCOCC(CN2CCN(C)CC2)O1

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.30
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HRH1 P35367 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
SCHEMBL2581450 0.90 GAA (0.33)
SCHEMBL2584255 0.90 GAA (0.38)
SCHEMBL301481 0.87 HRH3 (0.33) HRH3HTR2AHTR2CHRH1
SCHEMBL321029 0.84 HTR2A (0.32) HTR2AHTR2CHRH1
SCHEMBL320684 0.82
SCHEMBL302241 0.82
SCHEMBL303012 0.81 HTR2A (0.33) HRH3HTR2AHTR2CHRH1
SCHEMBL301474 0.79 HTR2A (0.37) HRH3HTR2AHTR2CHRH1
SCHEMBL301451 0.78 HRH3 (0.34) HRH3HTR2AHTR2CHRH1
SCHEMBL21049518 0.78 HRH3 (0.34) HRH3HTR2AHTR2CHRH1

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
EP-2404924-B1 Aqueous solution of piperazinyl-containing silanol compound and making method SHINETSU CHEMICAL CO (JP) 2013-03-20 EP disclosed
US-20120006229-A1 AQUEOUS SOLUTION OF PIPERAZINYL-CONTAINING SILANOL COMPOUND AND MAKING METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-01-12 US disclosed
EP-2404924-A1 Aqueous solution of piperazinyl-containing silanol compound and making method Shin-Etsu Chemical Co., Ltd. (JP) 2012-01-11 EP disclosed
US-8049027-B2 Organosilicon compound having amino group and its production method SHIN-ETSU CHEMICAL CO., LTD. (JP) 2011-11-01 US disclosed
US-20100099866-A1 ORGANOSILICON COMPOUND HAVING AMINO GROUP AND ITS PRODUCTION METHOD SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-04-22 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-20100099866-A1 ORGANOSILICON COMPOUND HAVING AMINO GROUP AND ITS PRODUCTION METHOD HRH3, H1-0, H1-2 HRH3 1/4885HTR2A 927/4885HTR2C 851/4885

“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.