SCHEMBL11266919

SCHEMBL11266919

C=COC(=O)C(C(C)=O)C(C)=O

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.32

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
SCHEMBL491255 0.95 ALDH1A1 (0.35) ALDH1A1TSHR
Acrylic Acid SCHEMBL11283606 0.91 LMNA (0.42) ALDH1A1TSHR
Methacrylic Acid SCHEMBL9067227 0.78 TSHR (0.32) ALDH1A1TSHR
SCHEMBL28563059 0.76 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL20448650 0.76 ALDH1A1 (0.32) ALDH1A1TSHR
SCHEMBL93534 0.74
SCHEMBL19105201 0.74 TSHR (0.39) ALDH1A1TSHR
SCHEMBL10905696 0.73
Vinyl Chloride SCHEMBL7055813 0.73
SCHEMBL28857497 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4365040-A BINDERS FOR PAINTS OR LACQUERS WACKER-CHEMIE GMBH (DE) 1982-12-21 US disclosed