SCHEMBL8967283

SCHEMBL8967283

CC(C)CC[S+]([O-])CCCCCCl

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
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
SCHEMBL8967194 0.91
SCHEMBL3376449 0.82 ALDH1A1 (0.38) ALDH1A1TSHR
SCHEMBL11030115 0.80 LMNA (0.43)
SCHEMBL21550880 0.79 TSHR (0.38) ALDH1A1TSHR
SCHEMBL230996 0.79 CA1 (0.33) ALDH1A1
Alcohol SCHEMBL28425846 0.72 LMNA (0.37)
SCHEMBL23931188 0.71 LMNA (0.50) ALDH1A1TSHR
SCHEMBL9695892 0.71 LMNA (0.50) ALDH1A1TSHR
SCHEMBL4532996 0.71 LMNA (0.50) ALDH1A1TSHR
SCHEMBL6523739 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0468434-B1 Novel piperidyl ethers and thioethers as inhibitors of cholesterol biosynthesis MERRELL DOW PHARMA (US) 1996-02-28 EP disclosed
US-5348964-A Anticholesterol agents or fungicides MERRELL DOW PHARMACEUTICALS INC. (US) 1994-09-20 US disclosed
EP-0468434-A1 Novel piperidyl ethers and thioethers as inhibitors of cholesterol biosynthesis MERRELL PHARMACEUTICALS INC. (US) 1992-01-29 EP disclosed