SCHEMBL6699372

SCHEMBL6699372

CCCCC=C(C)C(=O)OCC(C)C

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 7/20 0.48
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ GRIK1 P39086 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.35
▸ EP300 Q09472 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ FAAH O00519 3/20 0.35
▸ ATM Q13315 1/20 0.33
▸ ZDHHC7 Q9NXF8 1/20 0.33
▸ PRKCA P17252 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
SCHEMBL21903331 0.93 TSHR (0.46) TSHREP300MAPTFAAHZDHHC7
SCHEMBL28152436 0.89 TSHR (0.52) TSHRCYP2D6CYP2C19GRIK1ALDH1A1
SCHEMBL28173402 0.86 TSHR (0.40) TSHRCYP2D6CYP2C19EP300MAPT
SCHEMBL20558669 0.84 TSHR (0.46) TSHRCYP2D6GRIK1ALDH1A1EP300
SCHEMBL22874083 0.83 CYP2D6 (0.49) TSHRCYP2D6CYP2C19GRIK1ALDH1A1
SCHEMBL11800167 0.83 TSHR (0.53) TSHRCYP2D6CYP2C19ALDH1A1MAPT
SCHEMBL374982 0.83 CYP2D6 (0.49) TSHRCYP2D6CYP2C19GRIK1ALDH1A1
SCHEMBL27330128 0.83 TSHR (0.37) TSHRCYP2D6CYP2C19EP300MAPT
SCHEMBL27536510 0.82 TSHR (0.55) TSHRCYP2D6CYP2C19ALDH1A1ATM
SCHEMBL8587018 0.81 ALDH1A1 (0.52) TSHRCYP2D6CYP2C19ALDH1A1EP300

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
EP-3389809-A1 COLUMN FOR THERMALLY TREATING FLUID MIXTURES BASF SE (DE) 2018-10-24 — — EP disclosed
EP-3325121-A1 COLUMN FOR THERMALLY TREATING FLUID MIXTURES, PARTICULARLY THOSE THAT CONTAIN (METH)ACRYLIC MONOMERS BASF SE (DE) 2018-05-30 — — EP disclosed
EP-3325122-A1 COLUMN FOR THERMALLY TREATING FLUID MIXTURES, PARTICULARLY THOSE THAT CONTAIN (METH)ACRYLIC MONOMERS BASF SE (DE) 2018-05-30 — — EP disclosed
US-9354367-B2 Color material dispersion liquid, color resin composition for color filters, color filter, liquid crystal display device, and organic light-emitting display device DAI NIPPON PRINTING CO., LTD. (JP) 2016-05-31 — — US disclosed
US-20150077685-A1 COLOR MATERIAL DISPERSION LIQUID, COLOR RESIN COMPOSITION FOR COLOR FILTERS, COLOR FILTER, LIQUID CRYSTAL DISPLAY DEVICE, AND ORGANIC LIGHT-EMITTING DISPLAY DEVICE DAI NIPPON PRINTING CO., LTD. (JP) 2015-03-19 — — US disclosed
US-20040121934-A1 Polymeric detergent additives DOUGHERTY RICHARD CHARLES (US) 2004-06-24 — — US disclosed
WO-1998011471-A1 DRY PEEL-APART IMAGING SYSTEM MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1998-03-19 — — WO disclosed
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