SCHEMBL804367

SCHEMBL804367

CCCCCCCCCCCC[Si](C)(C)O[Si](C)(C)CCCC

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
THRB P10828 1/20 0.42
DNM1 Q05193 6/20 0.33
ALDH1A1 P00352 3/20 0.33
LMNA P02545 3/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HSD17B10 Q99714 1/20 0.33
SLC22A1 O15245 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
SCHEMBL869304 0.97 TSHR (0.44) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL27630454 0.97 TSHR (0.44) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL17105916 0.97 TSHR (0.44) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL17105915 0.97 TSHR (0.44) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL771775 0.97 TSHR (0.44) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL173430 0.95 TSHR (0.39) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL15497547 0.92 TSHR (0.40) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL6274075 0.92 TSHR (0.37) TSHRTHRBLMNASLC22A1
SCHEMBL11200 0.92 TSHR (0.35) TSHRTHRBLMNA
SCHEMBL1696002 0.87 TSHR (0.40) TSHRTHRBDNM1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8399524-B2 Acyl acidic amino acid ester AJINOMOTO CO., INC. (JP) 2013-03-19 US disclosed
US-20120071570-A1 NOVEL ACYL ACIDIC AMINO ACID ESTER AJINOMOTO CO., INC. (JP) 2012-03-22 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-20120071570-A1 NOVEL ACYL ACIDIC AMINO ACID ESTER FFAR2, FFAR1, FFAR3 TSHR 3923/4885THRB 2394/4885DNM1 3607/4885

“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.