SCHEMBL9027367

SCHEMBL9027367

CCCCCCCCCCOCC1COC(c2ccccc2)OC1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL9670184 1.00 ALDH1A1 (0.50) ALDH1A1TDP1SMN1; SMN2
SCHEMBL1317869 0.84 ALDH1A1 (0.43) ALDH1A1TDP1
SCHEMBL1316572 0.84 ALDH1A1 (0.43) ALDH1A1TDP1
SCHEMBL1320721 0.84 ALDH1A1 (0.43) ALDH1A1TDP1
SCHEMBL1317886 0.84 ALDH1A1 (0.43) ALDH1A1TDP1
SCHEMBL11075645 0.84 ALDH1A1 (0.59) ALDH1A1TDP1SMN1; SMN2
SCHEMBL11074748 0.84 ALDH1A1 (0.59) ALDH1A1TDP1SMN1; SMN2
SCHEMBL7799158 0.80 PPARG (0.40) ALDH1A1TDP1
SCHEMBL2215031 0.80 PPARG (0.40) ALDH1A1TDP1
SCHEMBL2216976 0.80 PPARG (0.40) ALDH1A1TDP1

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-0416401-B1 Use of derivatives of phospholipides as antiviral pharmaceuticals and phospholipides BOEHRINGER MANNHEIM GMBH (DE) 1996-10-30 EP disclosed
US-5158942-A PROCESS OF USING PHOSPHOLIPID DERIVATIVES TO INHIBIT MULTIPLICATION OF THE HUMAN IMMUNODEFICIENCY VIRUS BOEHRINGER MANNHEIM GMBH (DE) 1992-10-27 US disclosed
EP-0416401-A2 Use of derivatives of phospholipides as antiviral pharmaceuticals and phospholipides Roche Diagnostics GmbH (DE) 1991-03-13 EP disclosed