SCHEMBL3052348

SCHEMBL3052348

CCOC(=O)CNC(=O)c1ccc(S(=O)(=O)Nc2cc(F)ccc2Oc2ccc(Br)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 7/20 0.45
PTGDR2 Q9Y5Y4 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
NHERF1 O14745 1/20 0.45
MRGPRX1 Q96LB2 1/20 0.44
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
CCR1 P32246 1/20 0.42
CCR5 P51681 1/20 0.42
MAPK14 Q16539 1/20 0.42

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
SCHEMBL3275031 0.95 MRGPRX1 (0.49) CCR2PTGDR2SMN1; SMN2NPC1RAB9A
SCHEMBL3054529 0.88 CCR2 (0.47) CCR2PTGDR2MRGPRX1ALDH1A1KMT2A
SCHEMBL3274521 0.86 CACNA1H (0.53) SMN1; SMN2NPC1RAB9AMRGPRX1ALDH1A1
SCHEMBL3274441 0.82 CCR2 (0.50) CCR2PTGDR2MRGPRX1ALDH1A1KMT2A
SCHEMBL3045528 0.81 TDP1 (0.54) PTGDR2SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL3274410 0.81 CACNA1H (0.58) CCR2PTGDR2SMN1; SMN2NPC1RAB9A
SCHEMBL3039982 0.81 CCR2 (0.58) CCR2MRGPRX1CCR1CCR5
SCHEMBL3052650 0.81 CCR2 (0.48) CCR2PTGDR2ALDH1A1KMT2ACCR1
SCHEMBL3273893 0.80 TDP1 (0.49) CCR2SMN1; SMN2NPC1RAB9AMRGPRX1
SCHEMBL3982945 0.80 MRGPRX1 (0.50) CCR2MRGPRX1ALDH1A1KMT2ACCR1

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
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
EP-2057116-A1 NEW PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS Richter Gedeon NYRT (HU) 2009-05-13 EP 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 (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 CCR2 390/4885PTGDR2 225/4885SMN1; SMN2 4333/4885
US-20130029991-A1 New Phenylsulfamoyl Benzamide Derivatives as Bradykinin Antagonists BDKRB1, BDKRB2, HRH4 CCR2 371/4885PTGDR2 233/4885SMN1; SMN2 4307/4885
US-20100105686-A1 PHENYLSULFAMOYL BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, HRH1 CCR2 359/4885PTGDR2 244/4885SMN1; 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.