SCHEMBL539083

SCHEMBL539083

CCOCCC(OCC1CO1)C1CO1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 1/20 0.39
TSHR P16473 2/20 0.37
MAPK1 P28482 1/20 0.34

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
SCHEMBL539346 0.80 SMN1; SMN2 (0.31) SMN1; SMN2ALDH1A1
SCHEMBL270558 0.79 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL3151151 0.78 TSHR (0.34) SMN1; SMN2TSHR
SCHEMBL8374924 0.77 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL11003491 0.77 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL17275109 0.77 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1TSHR
SCHEMBL17473973 0.75 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL2427168 0.73 TSHR (0.37) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL27052120 0.72 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1
SCHEMBL3373685 0.72 ALDH1A1 (0.36) SMN1; SMN2ALDH1A1TDP1TSHRMAPK1

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
EP-2414431-A1 THINNERS FOR AQUEOUS SUSPENSIONS OF MINERAL PARTICLES AND HYDRAULIC BINDER PASTES Chryso (FR) 2012-02-08 EP disclosed
WO-2010112775-A1 THINNERS FOR AQUEOUS SUSPENSIONS OF MINERAL PARTICLES AND HYDRAULIC BINDER PASTES CHRYSO (FR) 2010-10-07 WO disclosed