SCHEMBL20515345

SCHEMBL20515345

C[Si](C)(C)Oc1ccco1.c1scc2c1OCCO2

nearest known ligand 0.32

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.32
CRHBP P24387 2/20 0.32
CRHR2 Q13324 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HTT P42858 1/20 0.32
ITGB2 P05107 1/20 0.31
ICAM1 P05362 1/20 0.31
ITGAL P20701 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GAA P10253 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
SCHEMBL2827455 0.79 TP53 (0.40) LMNAHTTALDH1A1GAA
Methoxymethane SCHEMBL28298291 0.69 ITGB2 (0.38) LMNACRHBPCRHR2SMN1; SMN2HTT
Benzene SCHEMBL27610541 0.69 ITGB2 (0.48) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL456419 0.69 ITGB2 (0.45) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL33274 0.69
SCHEMBL15981877 0.67 LMNA (0.52) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL15981871 0.67 LMNA (0.52) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL14587292 0.67 LMNA (0.52) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL15982300 0.67 LMNA (0.52) LMNACRHBPCRHR2SMN1; SMN2HTT
SCHEMBL14587294 0.67 LMNA (0.52) LMNACRHBPCRHR2SMN1; SMN2HTT

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-10821429-B2 Precatalysts and process for the metal-free functionalization of SP2 carbons using the same UNIVERSITé LAVAL (CA) 2020-11-03 US disclosed
US-20190262817-A1 PRECATALYSTS AND PROCESS FOR THE METAL-FREE FUNCTIONALIZATION OF SP2 CARBONS USING THE SAME UNIVERSITé LAVAL (CA) 2019-08-29 US disclosed
US-10258976-B2 Precatalysts and process for the metal-free functionalization of SP2 carbons using the same UNIVERSITé LAVAL (CA) 2019-04-16 US disclosed
EP-3389859-A1 PRECATALYSTS AND PROCESS FOR THE METAL-FREE FUNCTIONALIZATION OF SP2 CARBONS USING THE SAME Université Laval (CA) 2018-10-24 EP disclosed
US-20180280950-A1 PRECATALYSTS AND PROCESS FOR THE METAL-FREE FUNCTIONALIZATION OF SP2 CARBONS USING THE SAME UNIVERSITE LAVAL (CA) 2018-10-04 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 (2 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-10258976-B2 Precatalysts and process for the metal-free functionalization of SP2 carbons using the same SP1, LEF1, FOS LMNA 515/4885CRHBP 3816/4885CRHR2 3210/4885
US-20180280950-A1 PRECATALYSTS AND PROCESS FOR THE METAL-FREE FUNCTIONALIZATION OF SP2 CARBONS USING THE SAME SP1, LEF1, FOS LMNA 515/4885CRHBP 3816/4885CRHR2 3210/4885

“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.