SCHEMBL2951999

SCHEMBL2951999

CCC(C)c1cc(O)c(O)c(C(C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.44
CYP2D6 P10635 1/20 0.44
ALDH1A1 P00352 4/20 0.42
ALOX15 P16050 3/20 0.42
GAA P10253 2/20 0.42
USP2 O75604 1/20 0.42
PKM P14618 1/20 0.42
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
TSHR P16473 3/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
CYP3A4 P08684 1/20 0.42
RORC P51449 1/20 0.41
CA2 P00918 3/20 0.41
CA1 P00915 2/20 0.41
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
SMN1; SMN2 Q16637 2/20 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
SCHEMBL144821 0.91 CA2 (0.50) CYP1A2CYP2D6ALDH1A1ALOX15GAA
SCHEMBL12626206 0.84 CYP2C9 (0.52) CYP1A2CYP2D6ALDH1A1ALOX15GAA
SCHEMBL99080 0.83 CYP2C9 (0.47) CYP1A2CYP2D6ALDH1A1ALOX15GAA
SCHEMBL10778785 0.83 HSPA5 (0.56) CYP1A2CYP2D6ALDH1A1ALOX15GAA
SCHEMBL30337273 0.83 HSPA5 (0.56) CYP1A2CYP2D6ALDH1A1ALOX15GAA
SCHEMBL22190072 0.83 CYP1A2 (0.53) CYP1A2CYP2D6ALDH1A1ALOX15GAA
SCHEMBL23682242 0.82 USP2 (0.52) ALDH1A1ALOX15GAAUSP2PKM
SCHEMBL1116090 0.82 USP2 (0.52) ALDH1A1ALOX15GAAUSP2PKM
SCHEMBL4890157 0.81 ALDH1A1 (0.43) CYP1A2CYP2D6ALDH1A1ALOX15GAA
SCHEMBL8377857 0.81 CYP1A2 (0.57) CYP1A2CYP2D6ALDH1A1ALOX15GAA

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
EP-2020656-B1 OPTICAL DISK AND ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISK DAINIPPON INK & CHEMICALS (JP) 2012-11-21 EP claimed
US-20090207723-A1 OPTICAL DISC AND ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISC DIC CORPORATION (JP) 2009-08-20 US claimed
EP-2020656-A1 OPTICAL DISK AND ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISK DIC Corporation (JP) 2009-02-04 EP claimed
US-20070036935-A1 Optical disk DAINIPPON INK AND CHEMICALS, INC., (JP) 2007-02-15 US claimed
EP-1669989-A1 OPTICAL DISK DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-06-14 EP claimed
US-8722315-B2 Optical disc and ultraviolet-curable composition for optical disc DIC CORPORATION (JP) 2014-05-13 US disclosed
EP-2020656-B1 OPTICAL DISK AND ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISK DAINIPPON INK & CHEMICALS (JP) 2012-11-21 EP disclosed
US-20100278031-A1 ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISK AND OPTICAL DISK DIC CORPORATION 2010-11-04 US disclosed
US-7749587-B2 cured acrylate polymer containing monomers e.g. bisphenol A type epoxy acrylate, diacrylate of an ethylene oxide adduct of bisphenol A, dipropylene glycol diacrylate, lauryl acrylate etc.; ethyl dimethylaminobenzoate and 2,4,6-trimethylbenzoyldiphenylphosphine oxide as phtoinitiator; and gallic acid DAINIPPON INK AND CHEMICALS, INC. (JP) 2010-07-06 US disclosed
US-20090324870-A1 Utraviolet-curable composition for optical disk and optical disk DIC CORPORATION (JP) 2009-12-31 US disclosed
US-20090207723-A1 OPTICAL DISC AND ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISC DIC CORPORATION (JP) 2009-08-20 US disclosed
EP-2068319-A1 ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISK AND OPTICAL DISK DIC Corporation (JP) 2009-06-10 EP disclosed
EP-2020656-A1 OPTICAL DISK AND ULTRAVIOLET-CURABLE COMPOSITION FOR OPTICAL DISK DIC Corporation (JP) 2009-02-04 EP disclosed
US-20070036935-A1 Optical disk DAINIPPON INK AND CHEMICALS, INC., (JP) 2007-02-15 US disclosed
EP-1669989-A1 OPTICAL DISK DAINIPPON INK AND CHEMICALS, INC. (JP) 2006-06-14 EP disclosed