SCHEMBL3044402

SCHEMBL3044402

O=C(CNC(=O)c1ccc(S(=O)(=O)N(Oc2ccccc2)c2ccccc2)cc1)NC1CCC(CCN2CCCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.43
DRD3 P35462 7/20 0.41
HTR2A P28223 4/20 0.41
CCR2 P41597 3/20 0.41
USP5 P45974 1/20 0.40
CA12 O43570 1/20 0.39
CA9 Q16790 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL3149102 0.92 DRD2 (0.51) DRD2DRD3HTR2A
SCHEMBL3277557 0.87 NPC1 (0.45) USP5CA12CA9RAB9A
SCHEMBL3052623 0.87 BDKRB1 (0.41) DRD2DRD3HTR2ACCR2RAB9A
SCHEMBL3050743 0.87 BDKRB1 (0.43) DRD2DRD3HTR2ACCR2
SCHEMBL3157844 0.86 DRD2 (0.47) DRD2DRD3HTR2A
SCHEMBL3145983 0.86 DRD2 (0.50) DRD2DRD3HTR2A
SCHEMBL3049825 0.85 DRD2 (0.46) DRD2DRD3HTR2ACCR2
SCHEMBL3154271 0.83 DRD2 (0.44) DRD2DRD3HTR2A
SCHEMBL3982532 0.83 RAB9A (0.42) USP5RAB9A
SCHEMBL3143699 0.83 DRD2 (0.47) DRD2DRD3HTR2ACCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120295910-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BEKE GYULA (HU) 2012-11-22 US claimed
US-20100105686-A1 PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-04-29 US claimed
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 DRD2 462/4885DRD3 506/4885HTR2A 771/4885
US-20130029991-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BDKRB1, BDKRB2, HRH4 DRD2 528/4885DRD3 582/4885HTR2A 837/4885
US-20100105686-A1 PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, HRH1 DRD2 485/4885DRD3 510/4885HTR2A 781/4885

“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.