SCHEMBL7108232

SCHEMBL7108232

CC(C)C(C)(N)N(CCO)CCO

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL5014920 0.81 MAPT (0.32) MAPT
SCHEMBL28084585 0.72 MAPT (0.36) ALDH1A1MAPT
SCHEMBL18526301 0.69
SCHEMBL29562071 0.68 ALDH1A1 (0.38) ALDH1A1MAPT
SCHEMBL115482 0.68 MAPT (0.42) ALDH1A1MAPT
SCHEMBL22996231 0.67 RIPK1 (0.31)
SCHEMBL7927801 0.67 ALDH1A1 (0.41) ALDH1A1MAPT
SCHEMBL5016011 0.67 TSHR (0.30)
SCHEMBL21076279 0.66
Hydrochloric Acid SCHEMBL31612219 0.66 MAPT (0.40) ALDH1A1MAPT

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-1092737-B1 Catalyst composition for the production of a polyurethane resin, and method for producing a polyurethane resin TOSOH CORP (JP) 2003-09-24 EP claimed