SCHEMBL3179891

SCHEMBL3179891

CC(O[SiH](c1ccccc1)c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
ADRA2A P08913 2/20 0.36
ADRA2C P18825 2/20 0.36
ADRA2B P18089 1/20 0.36
TAAR1 Q96RJ0 3/20 0.35
TRPA1 O75762 3/20 0.35
CYP2D6 P10635 1/20 0.34
LMNA P02545 1/20 0.34
HIF1A Q16665 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NOS2 P35228 1/20 0.34
RORC P51449 2/20 0.33
ALDH1A1 P00352 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
SCHEMBL13528594 0.87 HTR2A (0.39) ADRA2ALMNAKDM4EALDH1A1
SCHEMBL3175071 0.85 ALDH1A1 (0.44) TRPA1LMNAALDH1A1
SCHEMBL17862086 0.83 HCAR2 (0.38) HCAR2ADRA2AADRA2CADRA2BTAAR1
SCHEMBL15302056 0.79 HCAR2 (0.41) HCAR2ADRA2AADRA2CADRA2BTAAR1
SCHEMBL3888063 0.79 ALDH1A1 (0.35) TAAR1TRPA1LMNAALDH1A1
SCHEMBL13528585 0.79 THRB (0.37) ADRA2AADRA2CTAAR1TRPA1CYP2D6
SCHEMBL23701039 0.76 TRPA1 (0.32) TAAR1TRPA1
SCHEMBL23701156 0.76 TSHR (0.33)
SCHEMBL1025648 0.76 HCAR2 (0.43) HCAR2ADRA2AADRA2CADRA2BTAAR1
SCHEMBL4622367 0.76 HCAR2 (0.39) HCAR2ADRA2AADRA2CADRA2BTAAR1

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-2066601-B1 HYDROSILYLATION AGENCY SCIENCE TECH & RES (SG) 2012-10-24 EP disclosed
US-20100016621-A1 Hydrosilylation AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-01-21 US disclosed
US-20100016621-A1 Hydrosilylation AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2010-01-21 US disclosed
EP-2066601-A1 HYDROSILYLATION Agency for Science, Technology And Research (SG) 2009-06-10 EP disclosed
WO-2008039154-A1 HYDROSILYLATION AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-04-03 WO 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-20100016621-A1 Hydrosilylation HACL2, HAO2, VIM HCAR2 1588/4885ADRA2A 2841/4885ADRA2C 3690/4885

“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.