SCHEMBL6574386

SCHEMBL6574386

CC(C)OC(CN)OC(C)C

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39

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
Acetic Acid SCHEMBL29194279 0.84 TSHR (0.35)
SCHEMBL19200580 0.78
SCHEMBL8288885 0.75 TSHR (0.48)
SCHEMBL12031784 0.75 TSHR (0.48)
SCHEMBL6574355 0.75 GABBR2 (0.39)
SCHEMBL4288199 0.73
SCHEMBL9238797 0.73 TSHR (0.41)
SCHEMBL18496313 0.73
SCHEMBL1683577 0.73 ALDH1A1 (0.33) ALDH1A1
SCHEMBL11377598 0.72 MAPK1 (0.30)

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6069269-A A NEW SYNTHETIC PROCESS BY CATALYTIC HYDROGENATING A DIASTEREOMERIC MIXTURE IN A HALOGENATED HYDROCARBON SOLVENT CHINOIN GYOGYSZER ES VEGYESZETI (HU) 2000-05-30 US claimed
EP-0817776-B1 FORMALDEHYDE-FREE 1,3,5-TRIAZINE BASED CROSSLINKERS CYTEC TECH CORP (US) 2004-05-06 EP disclosed
US-5783642-A Coating compositions containing 1,3,5-triazine compounds substituted with acetal and/or cyclized acetal-based groups CYTEC INDUSTRIES INC. (US) 1998-07-21 US disclosed
US-5777040-A Curable compositions containing 1,3,5-triazine compounds substituted with acetal and/or cyclized acetal-based groups CYTEC TECHNOLOGY CORP. (US) 1998-07-07 US disclosed
EP-0817776-A1 FORMALDEHYDE-FREE 1,3,5-TRIAZINE BASED CROSSLINKERS CYTEC TECHNOLOGY CORP. (US) 1998-01-14 EP disclosed
US-5672703-A CURING AGENTS CYTEC TECHNOLOGY CORP. (US) 1997-09-30 US disclosed
WO-1996029318-A1 FORMALDEHYDE-FREE 1,3,5-TRIAZINE BASED CROSSLINKERS CYTEC TECHNOLOGY CORP. (US) 1996-09-26 WO disclosed