SCHEMBL27299641

SCHEMBL27299641

CC1(C)OCC(CCCCN2CCSCC2)O1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.34
TMEM97 Q5BJF2 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
SOAT1 P35610 2/20 0.33
ALDH1A1 P00352 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
CHRM2 P08172 1/20 0.30
CHRM1 P11229 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
SCHEMBL27299616 0.80 TMEM97 (0.49) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL13130046 0.75 CA2 (0.47) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL3488211 0.74 CA2 (0.39) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL10972837 0.72 ALDH1A1 (0.52) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL12059431 0.72 ALDH1A1 (0.52) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL12349246 0.72 GAA (0.45) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL7154999 0.71 CA2 (0.50) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL18817541 0.71 CA2 (0.50) CA2TMEM97SIGMAR1ALDH1A1NPSR1
SCHEMBL10975960 0.71 ALDH1A1 (0.55) CA2ALDH1A1NPSR1
SCHEMBL20707235 0.71 CA2 (0.41) CA2TMEM97SIGMAR1ALDH1A1NPSR1

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
WO-2024031051-A1 LIPIDS FOR NUCLEIC ACID DELIVERY Life Technologies Corporation (US) 2024-02-08 WO disclosed