SCHEMBL2632408

SCHEMBL2632408

CC(C)CC(C)(O)C(C)(O)CC(C)C

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.35
FDPS P14324 1/20 0.35
ALDH1A1 P00352 2/20 0.33
CYP2C19 P33261 1/20 0.33
MMP8 P22894 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
SCHEMBL15119897 0.87 FDPS (0.32) TSHRFDPSALDH1A1CYP2C19
SCHEMBL12966575 0.84 FDPS (0.36) TSHRFDPS
SCHEMBL18502134 0.82 FDPS (0.30) FDPS
SCHEMBL9907229 0.82 AR (0.33) FDPS
SCHEMBL24746653 0.82 AR (0.33) FDPS
SCHEMBL23682614 0.82 AR (0.33) FDPS
SCHEMBL10903109 0.80
SCHEMBL1791710 0.79
SCHEMBL60827 0.79
SCHEMBL809181 0.79 TSHR (0.35) TSHRALDH1A1CYP2C19MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8273520-B2 Resin composition for laser engraving, relief printing plate precursor for laser engraving, relief printing plate and method of producing the same FUJIFILM CORPORATION (JP) 2012-09-25 US disclosed
US-20120094489-A1 CMP COMPOSITIONS AND METHODS FOR SUPPRESSING POLYSILICON REMOVAL RATES CABOT MICROELECTRONICS CORPORATION (US) 2012-04-19 US disclosed
US-20100159393-A1 METHOD OF DEVELOPING LITHOGRAPHIC PRINTING PLATE PRECURSORS KODAK GRAPHIC COMMUNICATIONS, GMBH (DE) 2010-06-24 US disclosed
US-20100075115-A1 DISPERSIONS OF POLYURETHANES, THEIR PREPARATION AND USE BASF SE (DE) 2010-03-25 US disclosed
US-20090191479-A1 RESIN COMPOSITION FOR LASER ENGRAVING, RELIEF PRINTING PLATE PRECURSOR FOR LASER ENGRAVING, RELIEF PRINTING PLATE AND METHOD OF PRODUCING THE SAME FUJIFILM CORPORATION (JP) 2009-07-30 US disclosed
WO-2008098972-A1 DISPERSIONS OF POLYURETHANES, THEIR PREPARATION AND USE BASF SE (DE) 2008-08-21 WO disclosed
US-7348300-B2 Acetylenic diol ethylene oxide/propylene oxide adducts and processes for their manufacture AIR PRODUCTS AND CHEMICALS, INC. (US) 2008-03-25 US disclosed
US-20070157849-A1 Recording liquids BASF AKIENGESELLSCHAFT (DE) 2007-07-12 US disclosed
WO-2007023336-A2 METHOD OF DEVELOPING LITHOGRAPHIC PRINTING PLATE PRECURSORS KODAK POLYCHROME GRAPHICS GMBH (DE) 2007-03-01 WO disclosed