SCHEMBL2582826

SCHEMBL2582826

C=C(C)C(=O)OCCCO.C=CC(=O)OCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.44
▸ HCAR2 Q8TDS4 1/20 0.43
▸ TDP1 Q9NUW8 3/20 0.42
▸ POLB P06746 1/20 0.42
▸ APEX1 P27695 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ THRB P10828 1/20 0.42
▸ TSHR P16473 6/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ L3MBTL1 Q9Y468 2/20 0.41
▸ TGM2 P21980 1/20 0.41
▸ AKR1B10 O60218 2/20 0.39
▸ AKR1B1 P15121 2/20 0.39
▸ CA12 O43570 1/20 0.39
▸ CA4 P22748 1/20 0.39
▸ CA6 P23280 1/20 0.39
▸ CA5A P35218 1/20 0.39
▸ CA7 P43166 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
SCHEMBL1395905 0.92 ALDH1A1 (0.46) ALDH1A1HCAR2TDP1POLBAPEX1
SCHEMBL4170802 0.88 ALDH1A1 (0.53) ALDH1A1HCAR2TDP1POLBLMNA
SCHEMBL28268541 0.88 TSHR (0.57) ALDH1A1HCAR2TDP1POLBAPEX1
SCHEMBL9638004 0.88 TSHR (0.57) ALDH1A1HCAR2TDP1POLBAPEX1
SCHEMBL7571673 0.86 THRB (0.46) ALDH1A1HCAR2TDP1POLBAPEX1
SCHEMBL7852013 0.85 TSHR (0.55) ALDH1A1HCAR2TDP1POLBAPEX1
SCHEMBL28246245 0.84 ALDH1A1 (0.49) ALDH1A1HCAR2TDP1LMNATHRB
SCHEMBL28311598 0.83 ALDH1A1 (0.47) ALDH1A1HCAR2TDP1POLBLMNA
Methacrylic Acid SCHEMBL28171879 0.83 HCAR2 (0.50) ALDH1A1HCAR2TDP1POLBLMNA
Propene SCHEMBL28187730 0.83 TSHR (0.52) ALDH1A1HCAR2TDP1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100189890-A1 HIGH ADHESION ACRYLATE COATINGS F0R A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INTERNATIONAL (FR) 2010-07-29 — — US claimed
US-7759433-B2 High adhesion acrylate coating for a photochromic ophthalmic lens ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2010-07-20 — — US claimed
EP-2167306-A2 HIGH ADHESION ACRYLATE COATINGS FOR A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INTERNATIONAL (COMPAGNIE GENERAL D'OPTIQUE) (FR) 2010-03-31 — — EP claimed
US-20090318619-A1 INITIATORS FOR OPTICAL COATING FORMULATIONS WITH REDUCED YELLOWNESS ESSILOR INTERNATIONAL (FR) 2009-12-24 — — US claimed
US-20080315162-A1 High adhesion acrylate coating for a photochromic ophthalmic lens ESSILOR INTERNATIONAL (FR) 2008-12-25 — — US claimed
WO-2008157607-A2 HIGH ADHESION ACRYLATE COATINGS FOR A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INTERNATIONAL (FR) 2008-12-24 — — WO claimed
EP-2167306-B1 HIGH ADHESION ACRYLATE COATINGS FOR A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INT (FR) 2013-04-17 — — EP disclosed
US-8048974-B2 Initiators for optical coating formulations with reduced yellowness ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE (FR) 2011-11-01 — — US disclosed
US-20100201010-A1 HIGH ADHESION ACRYLATE COATINGS FOR A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2010-08-12 — — US disclosed
US-20100189890-A1 HIGH ADHESION ACRYLATE COATINGS F0R A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INTERNATIONAL (FR) 2010-07-29 — — US disclosed
US-7759433-B2 High adhesion acrylate coating for a photochromic ophthalmic lens ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE) (FR) 2010-07-20 — — US disclosed
EP-2167306-A2 HIGH ADHESION ACRYLATE COATINGS FOR A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INTERNATIONAL (COMPAGNIE GENERAL D'OPTIQUE) (FR) 2010-03-31 — — EP disclosed
US-20090318619-A1 INITIATORS FOR OPTICAL COATING FORMULATIONS WITH REDUCED YELLOWNESS ESSILOR INTERNATIONAL (FR) 2009-12-24 — — US disclosed
US-20080315162-A1 High adhesion acrylate coating for a photochromic ophthalmic lens ESSILOR INTERNATIONAL (FR) 2008-12-25 — — US disclosed
WO-2008157607-A2 HIGH ADHESION ACRYLATE COATINGS FOR A PHOTOCHROMIC OPHTHALMIC LENS ESSILOR INTERNATIONAL (FR) 2008-12-24 — — WO disclosed
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