SCHEMBL29257598

SCHEMBL29257598

C=C[Sn](CCCC)(CCCC)CCCC(F)(F)F

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
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
SCHEMBL41245 0.82 TSHR (0.41) ALDH1A1TSHR
SCHEMBL11057751 0.80 TSHR (0.39) ALDH1A1TSHR
SCHEMBL1566900 0.80 TSHR (0.39) ALDH1A1TSHR
Alcohol SCHEMBL27998288 0.76 TSHR (0.36) ALDH1A1TSHR
SCHEMBL5457905 0.73 TSHR (0.46) ALDH1A1TSHR
SCHEMBL4856362 0.69
SCHEMBL60281 0.69
SCHEMBL7773897 0.68
SCHEMBL7773893 0.68
SCHEMBL8016190 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
CN-118047659-A Trifluoro vinyl transfer reagent and preparation method and application thereof 清华大学 2024-05-17 CN claimed
CN-118047659-A Trifluoro vinyl transfer reagent and preparation method and application thereof 清华大学 2024-05-17 CN disclosed