SCHEMBL3048013

SCHEMBL3048013

O=C(CNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2)cc1)NC1CCCCCC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TAOK1 Q7L7X3 1/20 0.46
TAOK3 Q9H2K8 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PTGDR2 Q9Y5Y4 2/20 0.46
PKM P14618 1/20 0.45
PTGDR Q13258 1/20 0.45
LMNA P02545 2/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
CACNA1H O95180 1/20 0.44
CACNA1B Q00975 1/20 0.44
ALDH1A1 P00352 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
MMP1 P03956 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
SCHEMBL3047849 1.00 TAOK1 (0.46) TAOK1TAOK3SMN1; SMN2PTGDR2PKM
SCHEMBL3040706 1.00 TAOK1 (0.46) TAOK1TAOK3SMN1; SMN2PTGDR2PKM
SCHEMBL3053914 0.99 TAOK1 (0.47) TAOK1TAOK3SMN1; SMN2PTGDR2PKM
SCHEMBL3982529 0.91 PTGDR2 (0.44) TAOK1TAOK3PTGDR2CACNA1HCACNA1B
Hydrochloric Acid SCHEMBL3047356 0.90 PTGDR2 (0.43) TAOK1TAOK3PTGDR2CACNA1HCACNA1B
SCHEMBL3044392 0.87 CCR2 (0.46) TAOK1TAOK3SMN1; SMN2
SCHEMBL3044395 0.87 CCR2 (0.46) TAOK1TAOK3SMN1; SMN2
SCHEMBL15103835 0.85 EPHX2 (0.45) SMN1; SMN2LMNA
SCHEMBL3044415 0.83 BDKRB1 (0.51) SMN1; SMN2LMNAALDH1A1
SCHEMBL3047854 0.83 PTGDR2 (0.57) PTGDR2CACNA1HCACNA1BTDP1POLB

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 4 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-20100105686-A1 PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-04-29 US 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 (3 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 TAOK1 2760/4885TAOK3 2142/4885SMN1; SMN2 4333/4885
US-20130029991-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BDKRB1, BDKRB2, HRH4 TAOK1 2897/4885TAOK3 2186/4885SMN1; SMN2 4307/4885
US-20100105686-A1 PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, HRH1 TAOK1 2921/4885TAOK3 2300/4885SMN1; SMN2 4111/4885

“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.