SCHEMBL3274307

SCHEMBL3274307

CN(C)CCCN1CCN(C(=O)CNC(=O)c2ccc(S(=O)(=O)Nc3ccccc3Oc3ccc(Cl)cc3Cl)cc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 10/20 0.46
KCNH2 Q12809 1/20 0.44
CACNA1H O95180 3/20 0.41
CACNA1B Q00975 3/20 0.41
GAA P10253 2/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PTGDR Q13258 1/20 0.40
PTGDR2 Q9Y5Y4 1/20 0.40
CCR1 P32246 1/20 0.40

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
SCHEMBL3274577 0.96 CCR2 (0.47) CCR2KCNH2GAAKDM4EALDH1A1
SCHEMBL3275572 0.91 CCR2 (0.54) CCR2KCNH2GAAPTGDRPTGDR2
SCHEMBL3273918 0.91 CCR2 (0.55) CCR2KCNH2PTGDRPTGDR2
SCHEMBL3274756 0.90 CCR2 (0.46) CCR2KCNH2GAAKDM4EALDH1A1
SCHEMBL3280567 0.90 CCR2 (0.52) CCR2KCNH2GAAPTGDRPTGDR2
SCHEMBL3158340 0.90 CACNA1H (0.44) CCR2CACNA1HCACNA1BGAAALDH1A1
SCHEMBL3274081 0.90 CCR2 (0.55) CCR2KCNH2GAAKDM4EALDH1A1
SCHEMBL3281588 0.89 GAA (0.51) CCR2KCNH2GAAKDM4EALDH1A1
SCHEMBL3275522 0.89 CCR2 (0.56) CCR2KCNH2GAAKDM4EALDH1A1
SCHEMBL15103932 0.89 CCR2 (0.46) CCR2KCNH2PTGDRPTGDR2CCR1

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-2076491-B1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-07-17 EP claimed
US-8481527-B2 Benzamide derivatives as bradykinin antagonists RICHTER GEDEON NYRT. (HU) 2013-07-09 US claimed
US-20100087423-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-04-08 US claimed
EP-2076491-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS Richter Gedeon NYRT (HU) 2009-07-08 EP claimed
WO-2008068540-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2008-06-12 WO claimed
EP-2076491-B1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT (HU) 2013-07-17 EP 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 (1 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-20100087423-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS BDKRB1, BDKRB2, HRH1 CCR2 380/4885KCNH2 55/4885CACNA1H 997/4885

“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.