SCHEMBL3959290

SCHEMBL3959290

CC(O)C(OCC(O)CCl)OCC(O)CCl

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 1/20 0.35
AR P10275 1/20 0.32
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL12515741 0.80
SCHEMBL9826879 0.80
SCHEMBL12516018 0.80
SCHEMBL15577364 0.79 ALDH1A1 (0.38) ALDH1A1TSHRCA1CA2CA9
SCHEMBL15577527 0.74 ALDH1A1 (0.38) ALDH1A1TSHRCA1CA2CA9
SCHEMBL10957305 0.72 CA1 (0.39) ALDH1A1TSHRCA1CA2CA9
SCHEMBL11150650 0.70 CA1 (0.47) ALDH1A1TSHRCA1CA2CA9
SCHEMBL10015473 0.70 TDP1 (0.33) ALDH1A1TSHRCA1CA2CA9
SCHEMBL12516048 0.69
SCHEMBL19648 0.69

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-2009143119-A2 ABSORBENT PRODUCT COMPRISING A CATIONIC MODIFIED STARCH THE PROCTER & GAMBLE COMPANY (US) 2009-11-26 WO disclosed