SCHEMBL6544702

SCHEMBL6544702

CC(C)CC(C=O)CCC=O

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 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
SCHEMBL28131138 0.84 ALDH1A1 (0.36) ALDH1A1TSHRSMN1; SMN2
SCHEMBL3122941 0.82 TSHR (0.35) TSHRSMN1; SMN2
SCHEMBL23277103 0.80 ALDH1A1 (0.33) ALDH1A1TSHRSMN1; SMN2
SCHEMBL276530 0.79 TSHR (0.36) ALDH1A1TSHRSMN1; SMN2ADH1BADH1C
SCHEMBL5694699 0.79 HIF1A (0.39) ALDH1A1TSHRSMN1; SMN2
SCHEMBL9770253 0.78 TSHR (0.44) ALDH1A1TSHRSMN1; SMN2ADH1BADH1C
SCHEMBL27598174 0.77 TSHR (0.50) ALDH1A1TSHRSMN1; SMN2
SCHEMBL1784052 0.77 HIF1A (0.40) ALDH1A1TSHRADH1BADH1CADH1A
SCHEMBL27560951 0.77 TSHR (0.36) ALDH1A1TSHRSMN1; SMN2
SCHEMBL27598112 0.77 TSHR (0.36) ALDH1A1TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0542217-A2 Substituted 1,5-pentanediols and processes for the preparation thereof UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP claimed
EP-1372703-A2 MATRIX STABILIZED ENZYME CRYSTALS AND METHODS OF USE IBEX TECHNOLOGIES (CA) 2004-01-02 EP disclosed
US-20020182201-A1 Matrix stabilized enzyme crystals and methods of use BIOMARIN PHARMACEUTICAL INC. 2002-12-05 US disclosed
WO-2002070646-A2 MATRIX STABILIZED ENZYME CRYSTALS AND METHODS OF USE IBEX TECHNOLOGIES (US) 2002-09-12 WO disclosed
US-5362519-A Polyesters particularly suitable for use in coating compositions which are sprayed with compressed fluids as vicosity reducing agents UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1994-11-08 US disclosed
US-5248752-A Improved moisture resistance, inks, coatings, sealants, adhesives UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-09-28 US disclosed
EP-0545110-A1 Polyesters for coating compositions which are sprayed with compressed fluids as viscosity reducing diluents UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-06-09 EP disclosed
EP-0545108-A1 Polyesters of branched aliphatic diols UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-06-09 EP disclosed
EP-0542220-A1 Polyurethanes and processes for preparing same UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed
EP-0542219-A2 Polyurethane (meth)acrylates and processes for preparing same UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed
EP-0542217-A2 Substituted 1,5-pentanediols and processes for the preparation thereof UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed
EP-0542218-A1 Conformal coating compositions UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1993-05-19 EP disclosed