SCHEMBL6043728

SCHEMBL6043728

CC([SiH3])C(C)(C)OC(N)=O

nearest known ligand 0.30

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 1/20 0.30
LMNA P02545 1/20 0.30
CYP2C9 P11712 1/20 0.30
TSHR P16473 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
SCHEMBL6983665 0.82 LMNA (0.33) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL27711944 0.78
SCHEMBL8853469 0.76 CHRM2 (0.30) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL28264411 0.76 CHRM2 (0.30) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL8479451 0.76
SCHEMBL28995927 0.76 ALOX15 (0.34) LMNA
SCHEMBL5580282 0.76 CA1 (0.31)
SCHEMBL15685824 0.73 LMNA (0.30) LMNA
SCHEMBL110853 0.73 LMNA (0.30) LMNA
SCHEMBL28745604 0.73 CTSK (0.32) CHRM3

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103415525-B Bromine domain inhibitor and uses thereof CONSTELLATION PHARMACEUTICALS, INC. (US) 2016-05-18 CN disclosed
CN-104114170-A Use of 4' -deferthionin analogues UNIV FLORIDA 2014-10-22 CN disclosed
CN-103648493-A Subcutaneously infusible levodopa prodrug compositions and methods of infusion SYNAGILE CORP 2014-03-19 CN disclosed
CN-103201034-A Catalysts and methods for polymer synthesis NOVOMER INC 2013-07-10 CN disclosed
CN-102655745-A Use of antibacterial agents for treating epithelial-related conditions SIGNUM BIOSCIENCES INC 2012-09-05 CN disclosed
CN-102245021-A Ansamycin hydroquinone compositions INFINITY DISCOVERY INC 2011-11-16 CN disclosed
CN-102209532-A Method for reducing small, dense LDL particles METABOLEX INC 2011-10-05 CN disclosed
CN-101065148-A Conjugated complement cascade inhibitors DIMENSIONAL PHARM INC (US) 2007-10-31 CN disclosed
US-20060079533-A1 Methods of treating alzheimer's disease NIEMAN JAMES A 2006-04-13 US disclosed
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 WO disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 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-20060079533-A1 Methods of treating alzheimer's disease BACE1, PSEN1, PSEN2 CHRM2 39/4885CHRM4 129/4885CHRM5 128/4885

“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.