SCHEMBL8640879

SCHEMBL8640879

C=C1CCC(=O)OC(=C)C1

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.48

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
SCHEMBL2148245 0.82 TSHR (0.58) TSHR
SCHEMBL451822 0.78
SCHEMBL16089 0.78
SCHEMBL2554446 0.78
SCHEMBL5357477 0.69
SCHEMBL8759010 0.69
Formaldehyde SCHEMBL23753933 0.68 TSHR (0.85) TSHR
Ethylene SCHEMBL2923714 0.68
Ethylene SCHEMBL11260915 0.68 TSHR (0.85) TSHR
SCHEMBL16123 0.67

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-5739358-A Synthesis of acetogenins REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1998-04-14 US disclosed
US-5677467-A Synthesis of acetogenins REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1997-10-14 US disclosed