SCHEMBL9244753

SCHEMBL9244753

CCOC(=O)C=CC(=O)OOOC(C)(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.52
NPSR1 Q6W5P4 1/20 0.41
MAPT P10636 7/20 0.40
ATM Q13315 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38
CA9 Q16790 1/20 0.38
CA14 Q9ULX7 1/20 0.38
LMNA P02545 3/20 0.36
MDM2 Q00987 2/20 0.36
ALDH1A1 P00352 3/20 0.36
TTR P02766 1/20 0.35
DPP4 P27487 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
MDM4 O15151 1/20 0.34
HTT P42858 1/20 0.34
CYP3A4 P08684 1/20 0.33
GLO1 Q04760 1/20 0.33

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
SCHEMBL9244750 1.00 HCAR2 (0.52) HCAR2NPSR1MAPTATMCA12
SCHEMBL8740249 0.89 HCAR2 (0.55) HCAR2NPSR1MAPTATMCA12
SCHEMBL3892606 0.86 HCAR2 (0.38) HCAR2ALDH1A1
SCHEMBL3892611 0.86 HCAR2 (0.38) HCAR2ALDH1A1
SCHEMBL399608 0.86 HCAR2 (0.38) HCAR2ALDH1A1
SCHEMBL9240319 0.86 HCAR2 (0.48) HCAR2NPSR1MAPTATMCA12
SCHEMBL9240325 0.86 HCAR2 (0.48) HCAR2NPSR1MAPTATMCA12
SCHEMBL8892638 0.83 ATM (0.65) HCAR2NPSR1MAPTATMALDH1A1
SCHEMBL8892632 0.83 ATM (0.65) HCAR2NPSR1MAPTATMALDH1A1
SCHEMBL9239941 0.83 HCAR2 (0.46) HCAR2NPSR1MAPTATMCA12

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-0434362-B1 Graft copolymer, solution containing the graft copolymer, and method of treating contact lens with the solution TOMEI SANGYO KK (JP) 1995-03-22 EP disclosed
EP-0433046-B1 Polymer-type polymerization initiator TOMEI SANGYO KK (JP) 1994-08-10 EP disclosed
US-5206298-A GRAFT COPOLYMER, SOLUTION CONTAINING THE GRAFT COPOLYMER FOR TREATING CONTACT LENS, AND METHOD OF TREATING CONTACT LENS WITH THE SOLUTION AND MAKING HYDROPHILIC LENS SURFACE TOMEI SANGYO KABUSHIKI KAISHA (JP) 1993-04-27 US disclosed
US-5134213-A N-Vinyllactam-Monoperoxyfumarate Terpolymer TOMEI SANGYO KABUSHIKI KAISHA (JP) 1992-07-28 US disclosed
US-5082912-A For graft polymerization, surfactants TOMEI SANGYO KABUSHIKI KAISHA (JP) 1992-01-21 US disclosed
EP-0434362-A1 Graft copolymer, solution containing the graft copolymer, and method of treating contact lens with the solution Tomei Sangyo Kabushiki Kaisha (JP) 1991-06-26 EP disclosed
EP-0433046-A2 Polymer-type polymerization initiator Tomei Sangyo Kabushiki Kaisha (JP) 1991-06-19 EP disclosed