SCHEMBL5014346

SCHEMBL5014346

C=CCN(CC=CO)C(=O)C1(CC=C)SCCCS1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
SLC6A2 P23975 2/20 0.30
SLC6A4 P31645 2/20 0.30
SLC6A3 Q01959 1/20 0.30
CYP2D6 P10635 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
SCHEMBL5014344 1.00 ALDH1A1 (0.30) ALDH1A1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5033531 0.94 ALDH1A1 (0.32) ALDH1A1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5033533 0.94 ALDH1A1 (0.32) ALDH1A1SLC6A2SLC6A4SLC6A3CYP2D6
SCHEMBL5048623 0.81 ALDH1A1 (0.30) ALDH1A1
SCHEMBL5033432 0.80
SCHEMBL5012313 0.74 ALDH1A1 (0.32) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL5015659 0.72 ALDH1A1 (0.31) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL5015660 0.72 ALDH1A1 (0.31) ALDH1A1SLC6A2SLC6A4SLC6A3
SCHEMBL5026024 0.71
SCHEMBL5033843 0.71 ALDH1A1 (0.32) ALDH1A1SLC6A2SLC6A4SLC6A3

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-20080053835-A1 Monomer Compound, Process for Producing the Same, Polymer Thereof, and Water-Based Curable Composition KANSAI PAINT CO., LTD. (JP) 2008-03-06 US disclosed
EP-1798218-A1 MONOMER COMPOUND, PROCESS FOR PRODUCING THE SAME, POLYMER THEREOF, AND WATER-BASED CURABLE COMPOSITION KANSAI PAINT CO., LTD. (JP) 2007-06-20 EP 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-20080053835-A1 Monomer Compound, Process for Producing the Same, Polymer Thereof, and Water-Based Curable Composition THEM6, PAM, WEE1 ALDH1A1 741/4885SLC6A2 4712/4885SLC6A4 3397/4885

“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.