SCHEMBL6837511

SCHEMBL6837511

CC(=O)CC(=O)OC(C)OC(=O)CC(C)=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.55
GAA P10253 1/20 0.55
SI P14410 1/20 0.55
MGAM2 Q2M2H8 1/20 0.55
ALDH1A1 P00352 4/20 0.38
TSHR P16473 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
HTT P42858 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
EGLN1 Q9GZT9 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
SCHEMBL29142606 0.93 MGAM (0.48) MGAMGAASIMGAM2ALDH1A1
SCHEMBL644901 0.88 MGAM (0.54) MGAMGAASIMGAM2ALDH1A1
SCHEMBL11276451 0.86 MGAM (0.46) MGAMGAASIMGAM2ALDH1A1
SCHEMBL112876 0.85 TSHR (0.42) MGAMGAASIMGAM2ALDH1A1
SCHEMBL28556735 0.84 MGAM (0.50) MGAMGAASIMGAM2ALDH1A1
SCHEMBL10570400 0.84 MGAM (0.44) MGAMGAASIMGAM2ALDH1A1
SCHEMBL4622681 0.84 MGAM (0.44) MGAMGAASIMGAM2ALDH1A1
SCHEMBL29438274 0.84 MGAM (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL8751786 0.84 MGAM (0.55) MGAMGAASIMGAM2ALDH1A1
SCHEMBL182320 0.84 MGAM (0.55) MGAMGAASIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6765056-B2 ALDEHYDE-FUNCTIONAL POLYURETHANE COMPRISING DISPERSING GROUPS, AND A LOW MOLECULAR WEIGHT ALDEHYDE-REACTIVE CROSSLINKER SELECTED FROM POLYAMINES AND CYANO, SULFO, KETO-, PHOSPHONO, OR NITRO-FUNCTIONAL COMPOUNDS; REFINISHING CARS AKZO NOBEL N.V. (NL) 2004-07-20 US disclosed
US-6753383-B2 REDUCING FREE ALDEHYDES IN DISPERSIONS, SUSPENSIONS, EMULSIONS AND SOLUTIONS BY SCAVENGING WITH A THIOAMINE COMPOUND; ODORLESS; NONTOXIC; DISCOLORATION INHIBITION; TEXTILES; GASES CONSORTIUM FUER ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 2004-06-22 US disclosed
EP-1216962-B1 Method for removing free aldehydes CONSORTIUM ELEKTROCHEM IND (DE) 2003-10-15 EP disclosed
EP-1307496-A1 AQUEOUS CROSS-LINKABLE BINDER COMPOSITION AND ITS USE IN THE PRODUCTION OF LACQUER COATINGS Akzo Nobel N.V. (NL) 2003-05-07 EP disclosed
EP-1216962-A1 Method for removing free aldehydes Consortium für elektrochemische Industrie GmbH (DE) 2002-06-26 EP disclosed
US-20020040093-A1 Aqueous cross-linkable binder composition and its use in the production of lacquer coatings AKZO NOBEL N. V. (NL) 2002-04-04 US disclosed
WO-2002014399-A1 AQUEOUS CROSS-LINKABLE BINDER COMPOSITION AND ITS USE IN THE PRODUCTION OF LACQUER COATINGS AKZO NOBEL N.V. (NL) 2002-02-21 WO disclosed
US-5453449-A Automobiles HERBERTS GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1995-09-26 US disclosed
US-5084536-A Reaction product of olefinically unsaturated compounds with compounds containing active hydrogen, processes for their preparation and 2-component lacquers based thereon HOECHST AG (DE) 1992-01-28 US disclosed
US-4871822-A Reaction product of olefinically unsaturated compounds with compounds containing active hydrogen, processes for their preparation and 2-component lacquers based thereon HOE 85/F O36J HOECHST AG (DE) 1989-10-03 US disclosed