SCHEMBL5477386

SCHEMBL5477386

C=CC(OC(=O)C(=C)C#N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL11500858 0.77 ALDH1A1 (0.42) ALDH1A1TSHR
SCHEMBL25432688 0.76 ALDH1A1 (0.46) ALDH1A1TSHR
SCHEMBL548209 0.76 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL169726 0.75 ALDH1A1 (0.39) ALDH1A1TSHR
SCHEMBL6035050 0.74 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL2529839 0.73 ALDH1A1 (0.43) ALDH1A1TSHR
SCHEMBL1489551 0.71 LMNA (0.32) ALDH1A1
SCHEMBL1489552 0.71 LMNA (0.32) ALDH1A1
SCHEMBL5477390 0.70 HCAR2 (0.31)
SCHEMBL230496 0.70 ALDH1A1 (0.52) ALDH1A1TSHR

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
CN-101420923-A Medical implant and fibrosis-inducing agent ANGIOTECH INT AG (CH) 2009-04-29 CN disclosed
CN-101227935-A Compositions and methods for treating diverticulum disease ANGIOTECH INT AG (CH) 2008-07-23 CN disclosed
US-20070092483-A1 Surgical adhesive compostion and process for enhanced tissue closure and healing POLLOCK POLYMER GROUP 2007-04-26 US disclosed
US-5350798-A Cyanoacrylate and oxalic acid polyester THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1994-09-27 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-20070092483-A1 Surgical adhesive compostion and process for enhanced tissue closure and healing MMP1, CTSF, OGFR ALDH1A1 1498/4885TSHR 3867/4885

“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.