SCHEMBL31568698

SCHEMBL31568698

C=CCC[C@H](CC[C@H](C)CC)C(=C)C

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 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
SCHEMBL31568700 1.00 TSHR (0.30) TSHR
SCHEMBL27916372 1.00 TSHR (0.30) TSHR
SCHEMBL31568696 1.00 TSHR (0.30) TSHR
SCHEMBL31568693 1.00 TSHR (0.30) TSHR
Acetic Acid SCHEMBL28803386 0.93 PLA2G2C (0.31)
Acetic Acid SCHEMBL27782101 0.87
SCHEMBL23927794 0.85
SCHEMBL21174928 0.85
SCHEMBL21174926 0.85
SCHEMBL22151183 0.85

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
CN-113912494-B Preparation method and intermediate of 6-isopropenyl-3-methyl-9-decenyl acetate 信越化学工业株式会社 2025-05-13 CN disclosed