SCHEMBL4736294

SCHEMBL4736294

C[Si](C)(C)C#Cc1ccc([Si](C)(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
GABRA3 P34903 2/20 0.37
GABRA2 P47869 2/20 0.37
NR1H2 P55055 1/20 0.34
NR1H3 Q13133 1/20 0.34
GRM5 P41594 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
SCHEMBL1306384 0.87 GABRA1 (0.38) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1306505 0.85 APP (0.41) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL2854252 0.80 CYP1A1 (0.44) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL19174201 0.78 CYP1A1 (0.48) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL440124 0.78 GRM5 (0.50) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL853691 0.76 CYP2A6 (0.48)
SCHEMBL613688 0.76 MAOA (0.39) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1230904 0.76 GABRA1 (0.37) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1230907 0.76 APP (0.48) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL3347257 0.76 GRM5 (0.48) GABRA1GABRG2GABRB3GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161269-A1 Compounds 620 ASTRAZENECA AB (SE) 2008-07-03 US disclosed
US-20080161269-A1 Compounds 620 ASTRAZENECA AB (SE) 2008-07-03 US disclosed
WO-2008076045-A1 NOVEL 2-AMINO- 5-ARYL-IMIDAZOL-4 -ONES ASTRAZENECA AB (SE) 2008-06-26 WO disclosed
EP-1215247-B1 Curable polysiloxane compositions WACKER CHEMIE GMBH (DE) 2005-03-09 EP disclosed
US-6566430-B2 Crosslinking; molding materials WACKER-CHEMIE GMBH (DE) 2003-05-20 US disclosed
US-20020111426-A1 Curable organopolysiloxane compositions WACKER-CHEMIE GMBH (DE) 2002-08-15 US disclosed
EP-1215247-A1 Curable polysiloxane compositions Wacker-Chemie GmbH (DE) 2002-06-19 EP disclosed
US-6359098-B1 SHELF LIFE AS ONE-COMPONENT ADDITION-CURABLE ORGANOPOLYSILOXANES, AND EXTENDED POT LIFE FOR TWO-COMPONENT ADDITION-CURABLE ORGANOPOLYSILOXANES, WITHOUT COMPROMISING CROSSLINKING RATES OR LEVELS WACKER-CHEMIE GMBH (DE) 2002-03-19 US disclosed
EP-1077226-B1 Curable Polysiloxane Compositions WACKER CHEMIE GMBH (DE) 2002-01-23 EP disclosed
EP-1077226-A1 Curable Polysiloxane Compositions Wacker-Chemie GmbH (DE) 2001-02-21 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-20080161269-A1 Compounds 620 MAPT, PSEN1, PSEN2 GABRA1 831/4885GABRG2 1144/4885GABRB3 601/4885

“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.