SCHEMBL2901147

SCHEMBL2901147

CC(C)(NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2)cc1)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 3/20 0.51
CACNA1B Q00975 3/20 0.51
PTGDR2 Q9Y5Y4 3/20 0.50
TDP1 Q9NUW8 2/20 0.50
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 2/20 0.49
CCR1 P32246 1/20 0.47
CCR2 P41597 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
ACLY P53396 1/20 0.46
BCL2L1 Q07817 2/20 0.46
MCL1 Q07820 2/20 0.46
RAB9A P51151 1/20 0.45
LIMK2 P53671 1/20 0.45
TRIM24 O15164 1/20 0.44
BRD1 O95696 1/20 0.44
BRPF1 P55201 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44

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
SCHEMBL2897726 0.92 POLB (0.52) CACNA1HCACNA1BPTGDR2TDP1POLB
SCHEMBL2897956 0.82 CCR1 (0.60) CACNA1HCACNA1BPTGDR2TDP1POLB
SCHEMBL2898873 0.80 CA2 (0.52) CACNA1HCACNA1BPTGDR2TDP1POLB
SCHEMBL3744963 0.80 CA2 (0.52) CACNA1HCACNA1BPTGDR2TDP1POLB
SCHEMBL4043636 0.80 PTGDR2 (0.57) CACNA1HCACNA1BPTGDR2TDP1POLB
SCHEMBL3274401 0.80 POLB (0.72) CACNA1HCACNA1BPTGDR2TDP1POLB
SCHEMBL3047854 0.80 PTGDR2 (0.57) CACNA1HCACNA1BPTGDR2TDP1POLB
Hydrochloric Acid SCHEMBL3054708 0.80 ITGB3 (0.43) CACNA1HCACNA1BPTGDR2TDP1L3MBTL1
SCHEMBL3757218 0.79 POLB (0.55) CACNA1HCACNA1BPTGDR2TDP1POLB
SCHEMBL3045528 0.79 TDP1 (0.54) CACNA1HCACNA1BPTGDR2TDP1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2057116-B1 NEW PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-02-13 EP disclosed
US-20130029991-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BEKE GYULA (HU) 2013-01-31 US disclosed
US-20120295910-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BEKE GYULA (HU) 2012-11-22 US disclosed
US-20100298299-A1 NON-PEPTIDE DERIVATIVES AS BRADYKININ B1 ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-11-25 US disclosed
EP-2215055-A1 NEW NON-PEPTIDE DERIVATIVES AS BRADYKININ B1 ANTAGONISTS Richter Gedeon Nyrt. (HU) 2010-08-11 EP disclosed
US-20100105686-A1 PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-04-29 US disclosed
EP-2057116-A1 NEW PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS Richter Gedeon NYRT (HU) 2009-05-13 EP disclosed
WO-2009053763-A1 NEW NON-PEPTIDE DERIVATIVES AS BRADYKININ BL ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2009-04-30 WO disclosed
WO-2008050167-A1 NEW PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2008-05-02 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-20120295910-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BDKRB1, BDKRB2, HRH4 CACNA1H 1604/4885CACNA1B 1550/4885PTGDR2 225/4885
US-20130029991-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BDKRB1, BDKRB2, HRH4 CACNA1H 1596/4885CACNA1B 1486/4885PTGDR2 233/4885
US-20100105686-A1 PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, HRH1 CACNA1H 1681/4885CACNA1B 1599/4885PTGDR2 244/4885
US-20100298299-A1 NON-PEPTIDE DERIVATIVES AS BRADYKININ B1 ANTAGONISTS BDKRB1, BDKRB2, NPBWR1 CACNA1H 1671/4885CACNA1B 881/4885PTGDR2 246/4885

“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.