SCHEMBL21404697

SCHEMBL21404697

C=CCOC(=O)NCCOCCOCCOC(=O)C(=C)C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.50
TSHR P16473 5/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ACHE P22303 3/20 0.37
ALDH1A1 P00352 4/20 0.36
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.34
HRH4 Q9H3N8 2/20 0.34
HRH3 Q9Y5N1 2/20 0.34
ERN1 O75460 3/20 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
SCHEMBL21404724 1.00 THRB (0.50) THRBTSHRLMNASMN1; SMN2ACHE
SCHEMBL586950 0.92 THRB (0.42) THRBTSHRLMNASMN1; SMN2ACHE
SCHEMBL21055715 0.90 THRB (0.41) THRBTSHRACHEALDH1A1HRH4
SCHEMBL22035555 0.88 THRB (0.59) THRBTSHRLMNASMN1; SMN2ACHE
SCHEMBL21404638 0.87 THRB (0.50) THRBTSHRACHEHRH4HRH3
SCHEMBL13872027 0.86 THRB (0.58) THRBTSHRLMNASMN1; SMN2ACHE
SCHEMBL2407776 0.86 THRB (0.58) THRBTSHRLMNASMN1; SMN2ACHE
SCHEMBL28282736 0.86 THRB (0.61) THRBTSHRALDH1A1TP53HIF1A
SCHEMBL21404692 0.85 TSHR (0.47) THRBTSHRACHEHRH4HRH3
SCHEMBL21404664 0.85 TSHR (0.47) THRBTSHRACHEHRH4HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12152045-B2 Silane coupling compounds and medical and/or dental curable compositions comprising the same KABUSHIKI KAISHA SHOFU (JP) 2024-11-26 US disclosed
US-20210122770-A1 SILANE COUPLING COMPOUNDS AND MEDICAL AND/OR DENTAL CURABLE COMPOSITIONS COMPRISING THE SAME KABUSHIKI KAISHA SHOFU (JP) 2021-04-29 US disclosed
US-10975229-B2 Silane coupling compounds and medical and/or dental curable compositions comprising the same KABUSHIKI KAISHA SHOFU (JP) 2021-04-13 US disclosed
US-20190300552-A1 SILANE COUPLING COMPOUNDS AND MEDICAL AND/OR DENTAL CURABLE COMPOSITIONS COMPRISING THE SAME KABUSHIKI KAISHA SHOFU (JP) 2019-10-03 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 (4 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-20210122770-A1 SILANE COUPLING COMPOUNDS AND MEDICAL AND/OR DENTAL CURABLE COMPOSITIONS COMPRISING THE SAME SMCHD1, CAD, EPM2A THRB 3383/4885TSHR 2902/4885LMNA 1474/4885
US-10975229-B2 Silane coupling compounds and medical and/or dental curable compositions comprising the same SMCHD1, CAD, EPM2A THRB 3383/4885TSHR 2902/4885LMNA 1474/4885
US-12152045-B2 Silane coupling compounds and medical and/or dental curable compositions comprising the same SMCHD1, CAD, EPM2A THRB 3383/4885TSHR 2902/4885LMNA 1474/4885
US-20190300552-A1 SILANE COUPLING COMPOUNDS AND MEDICAL AND/OR DENTAL CURABLE COMPOSITIONS COMPRISING THE SAME SMCHD1, CAD, EPM2A THRB 3383/4885TSHR 2902/4885LMNA 1474/4885

“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.