SCHEMBL4160504

SCHEMBL4160504

O=c1cc(CN2CCOCC2)occ1O

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TYR P14679 5/20 0.54
DAO P14920 3/20 0.54
KDM4E B2RXH2 1/20 0.54
APP P05067 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
IDH1 O75874 1/20 0.45
CYP2C9 P11712 1/20 0.44
ALOX15 P16050 1/20 0.44
HSD17B10 Q99714 1/20 0.44
HTT P42858 1/20 0.43

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
SCHEMBL19331445 0.86 TYR (0.56) TYRDAOKDM4EHRH3IDH1
SCHEMBL8346737 0.83 KDM4E (0.57) TYRDAOKDM4EAPPHRH3
Bromide SCHEMBL4417981 0.82 KDM4E (0.56) TYRDAOKDM4EAPPHRH3
SCHEMBL4421795 0.81 DAO (0.50) TYRDAOKDM4EIDH1
SCHEMBL20300238 0.76 IDH1 (0.54) TYRDAOKDM4EIDH1
SCHEMBL29843619 0.76 IDH1 (0.54) TYRDAOKDM4EIDH1
SCHEMBL21198763 0.75 HTT (0.54) KDM4ECYP2C9ALOX15HSD17B10HTT
SCHEMBL20323897 0.75 TYR (0.50) TYRDAOKDM4EIDH1
SCHEMBL4424950 0.74 KDM4E (0.47) TYRDAOKDM4E
SCHEMBL30090261 0.74 PKM (0.52) TYRDAOKDM4EIDH1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090216014-A1 NOVEL COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS EXONHIT THERAPEUTICS SA (FR) 2009-08-27 US disclosed
US-20090216014-A1 NOVEL COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS EXONHIT THERAPEUTICS SA (FR) 2009-08-27 US disclosed
US-20090216014-A1 NOVEL COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS EXONHIT THERAPEUTICS SA (FR) 2009-08-27 US disclosed
US-20090093471-A1 Methods of Treating Nervous Disorders EXONHIT THERAPEUTICS SA (FR) 2009-04-09 US disclosed
US-20090093471-A1 Methods of Treating Nervous Disorders EXONHIT THERAPEUTICS SA (FR) 2009-04-09 US disclosed
US-20090093471-A1 Methods of Treating Nervous Disorders EXONHIT THERAPEUTICS SA (FR) 2009-04-09 US disclosed
US-7514432-B2 Compounds and methods of treating cell proliferative diseases, retinopathies and arthritis EXONHIT THERAPEUTICS SA (FR) 2009-04-07 US disclosed
US-7514432-B2 Compounds and methods of treating cell proliferative diseases, retinopathies and arthritis EXONHIT THERAPEUTICS SA (FR) 2009-04-07 US disclosed
US-7514432-B2 Compounds and methods of treating cell proliferative diseases, retinopathies and arthritis EXONHIT THERAPEUTICS SA (FR) 2009-04-07 US disclosed
EP-1951247-A2 METHODS OF TREATING NERVOUS DISORDERS Exhonit Therapeutics SA (FR) 2008-08-06 EP disclosed
WO-2007031878-A2 METHODS OF TREATING NERVOUS DISORDERS EXONHIT THERAPEUTICS SA (FR) 2007-03-22 WO disclosed
WO-2007031878-A2 METHODS OF TREATING NERVOUS DISORDERS EXONHIT THERAPEUTICS SA (FR) 2007-03-22 WO disclosed
US-20070027146-A1 Methods of treating nervous disorders EXONHIT THERAPEUTICS SA (FR) 2007-02-01 US disclosed
US-20070027146-A1 Methods of treating nervous disorders EXONHIT THERAPEUTICS SA (FR) 2007-02-01 US disclosed
US-20070027146-A1 Methods of treating nervous disorders EXONHIT THERAPEUTICS SA (FR) 2007-02-01 US disclosed
US-20060183749-A1 Novel compounds and methods of treating cell proliferative diseases, retinopathies and arthritis EXONHIT THERAPEUTICS SA (FR) 2006-08-17 US disclosed
EP-1597253-B1 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS EXONHIT THERAPEUTICS SA (FR) 2006-08-09 EP disclosed
EP-1597253-A2 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS Exonhit Therapeutics S.A. (FR) 2005-11-23 EP disclosed
WO-2004076445-A2 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS EXONHIT THERAPEUTICS SA (FR) 2004-09-10 WO disclosed
WO-2004076445-A2 COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS EXONHIT THERAPEUTICS SA (FR) 2004-09-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070027146-A1 Methods of treating nervous disorders RAC1, GAP43, RAC2 TYR 763/4885DAO 1963/4885KDM4E 4414/4885
US-20090216014-A1 NOVEL COMPOUNDS AND METHODS OF TREATING CELL PROLIFERATIVE DISEASES, RETINOPATHIES AND ARTHRITIS RB1, ALDH1A2, CDK4 TYR 421/4885DAO 4494/4885KDM4E 2345/4885
US-20090093471-A1 Methods of Treating Nervous Disorders RAC1, IAPP, RAC2 TYR 1400/4885DAO 2122/4885KDM4E 4674/4885
US-20060183749-A1 Novel compounds and methods of treating cell proliferative diseases, retinopathies and arthritis RB1, ALDH1A2, CDK4 TYR 421/4885DAO 4494/4885KDM4E 2345/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.