SCHEMBL2789477

SCHEMBL2789477

Cc1c(-c2ccccc2)cc(C(C)(C)C)c(O)c1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.57
GLRB P48167 1/20 0.57
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
PTPN1 P18031 3/20 0.41
TNFRSF1A P19438 1/20 0.40
PTGS1 P23219 2/20 0.40
HNF4A P41235 1/20 0.39
CA2 P00918 2/20 0.39
CA1 P00915 1/20 0.39
AKR1C3 P42330 1/20 0.39
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38
TYR P14679 1/20 0.38

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
SCHEMBL4122027 0.87 GLRA3 (0.69) GLRA3GLRBMEN1KMT2AGAA
SCHEMBL2787696 0.87 GLRA3 (0.53) GLRA3GLRBMEN1KMT2APTGS1
SCHEMBL4125578 0.86 GLRA3 (0.49) GLRA3GLRBMEN1KMT2AGAA
SCHEMBL2789396 0.86 GLRA3 (0.49) GLRA3GLRBPTPN5
SCHEMBL4128724 0.85 GLRA3 (0.54) GLRA3GLRBMEN1KMT2AGAA
SCHEMBL2790755 0.85 GLRA3 (0.50) GLRA3GLRBCA2CA1CYP1A2
SCHEMBL2789471 0.85 GLRA3 (0.50) GLRA3GLRBMEN1KMT2AGAA
SCHEMBL2790750 0.84 GLRA3 (0.47) GLRA3GLRBMEN1KMT2APTPN1
SCHEMBL2790732 0.84 GLRA3 (0.47) GLRA3GLRBAKR1C3AKR1C2ALDH1A1
SCHEMBL4121457 0.84 GLRA3 (0.47) GLRA3GLRBCA2CA1AKR1C3

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100075932-A1 NOVEL SALICYLIC ANILIDES HIGH POINT PHARMACEUTICALS, LLC (US) 2010-03-25 US claimed
US-20100041657-A1 HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDICK A/S (DK) 2010-02-18 US claimed
US-7645791-B2 Salicylic anilides HIGH POINT PHARMACEUTICALS, LLC (US) 2010-01-12 US claimed
US-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR ASTRAZENECA AB (SE) 2009-07-30 US claimed
US-20090005434-A1 Novel Salicylic Anilides NOVO NORDISK A/S (DK) 2009-01-01 US claimed
EP-1890993-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR ANTAGONISTS OF GLYR AstraZeneca AB (SE) 2008-02-27 EP claimed
EP-1881961-A1 NEW HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDISK A/S (DK) 2008-01-30 EP claimed
US-20070004794-A1 Novel salicylic anilides NOVO NORDISK A/S (DK) 2007-01-04 US claimed
WO-2006120178-A1 NEW HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDISK A/S (DK) 2006-11-16 WO claimed
WO-2006121390-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR AGONISTS OF GLYR ASTRAZENECA AB (SE) 2006-11-16 WO claimed
EP-1689700-A1 NOVEL SALICYLIC ANILIDES NOVO NORDISK A/S (DK) 2006-08-16 EP claimed
WO-2005051894-A1 NOVEL SALICYLIC ANILIDES NOVO NORDISK A/S (DK) 2005-06-09 WO claimed
US-20100075932-A1 NOVEL SALICYLIC ANILIDES HIGH POINT PHARMACEUTICALS, LLC (US) 2010-03-25 US disclosed
US-20100041657-A1 HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDICK A/S (DK) 2010-02-18 US disclosed
US-7645791-B2 Salicylic anilides HIGH POINT PHARMACEUTICALS, LLC (US) 2010-01-12 US disclosed
US-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR ASTRAZENECA AB (SE) 2009-07-30 US disclosed
WO-2006120178-A1 NEW HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES NOVO NORDISK A/S (DK) 2006-11-16 WO disclosed
WO-2006121390-A2 BENZOIC ACID DERIVATIVES THAT ARE MODULATORS OR AGONISTS OF GLYR ASTRAZENECA AB (SE) 2006-11-16 WO disclosed
EP-1689700-A1 NOVEL SALICYLIC ANILIDES NOVO NORDISK A/S (DK) 2006-08-16 EP disclosed
WO-2005051894-A1 NOVEL SALICYLIC ANILIDES NOVO NORDISK A/S (DK) 2005-06-09 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 (5 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-20090192190-A1 Benzoic Acid Derivatives that are Modulators or Agonists of GlyR GLRA1, GLRB, GPBAR1 GLRA3 6/4885GLRB 2/4885MEN1 2512/4885
US-20100041657-A1 HALOALKYLSULFONE SUBSTITUTED COMPOUNDS USEFUL FOR TREATING OBESITY AND DIABETES RPS12, GPR119, ATP12A GLRA3 1540/4885GLRB 1915/4885MEN1 4083/4885
US-20090005434-A1 Novel Salicylic Anilides FABP4, ADIPOR1, ADIPOR2 GLRA3 3975/4885GLRB 3413/4885MEN1 4710/4885
US-20070004794-A1 Novel salicylic anilides FABP4, ADIPOR1, ADIPOR2 GLRA3 3975/4885GLRB 3413/4885MEN1 4710/4885
US-20100075932-A1 NOVEL SALICYLIC ANILIDES FABP4, ADIPOR1, ADIPOR2 GLRA3 3975/4885GLRB 3413/4885MEN1 4710/4885

“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.