SCHEMBL11075645

SCHEMBL11075645

CCCCCCCCCCCCOCC1COC(c2ccccc2)O1

nearest known ligand 0.59

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.50
TSHR P16473 1/20 0.44

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
SCHEMBL11074748 1.00 ALDH1A1 (0.59) ALDH1A1TDP1SMN1; SMN2TSHR
SCHEMBL7103917 0.88 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2
SCHEMBL7103919 0.88 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2
SCHEMBL7103922 0.88 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2
SCHEMBL1100795 0.88 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2
SCHEMBL8975163 0.85 ALDH1A1 (0.54) ALDH1A1TDP1SMN1; SMN2TSHR
SCHEMBL9670184 0.84 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2
SCHEMBL9027367 0.84 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2
SCHEMBL11086638 0.82 ALDH1A1 (0.53) ALDH1A1
SCHEMBL11087719 0.82 ALDH1A1 (0.53) ALDH1A1

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
EP-0103273-A1 Process for the preparation of glycerol ethers, and their use BEHRINGWERKE Aktiengesellschaft (DE) 1984-03-21 EP disclosed