SCHEMBL3275045

SCHEMBL3275045

O=C(O)CNC(=O)c1ccc(S(=O)(=O)N(Oc2ccc(OC(F)(F)F)cc2)c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR3 P49682 1/20 0.52
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47
CA1 P00915 2/20 0.47
CA2 P00918 2/20 0.47
CA9 Q16790 1/20 0.47
GCGR P47871 2/20 0.46
LMNA P02545 2/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
TRPV1 Q8NER1 4/20 0.45
EPHX2 P34913 2/20 0.44
FAAH O00519 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 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
SCHEMBL3281484 0.91 CA1 (0.47) CXCR3KEAP1NFE2L2CA1CA2
SCHEMBL3280632 0.89 SMN1; SMN2 (0.49) CXCR3LMNAGAAHTTEPHX2
SCHEMBL3047858 0.89 CA1 (0.54) CXCR3CA1CA2CA9SMN1; SMN2
SCHEMBL3273830 0.89 RAB9A (0.49) CXCR3CA1CA2CA9SMN1; SMN2
SCHEMBL3274948 0.85 TRPM8 (0.52) KEAP1NFE2L2LMNAGAAHTT
SCHEMBL3274296 0.84 CXCR3 (0.50) CXCR3GCGRLMNAGAAHTT
Hydrochloric Acid SCHEMBL3281104 0.84 CXCR3 (0.46) CXCR3KEAP1NFE2L2LMNAGAA
SCHEMBL15103961 0.83 CXCR3 (0.45) CXCR3CA9LMNAGAAHTT
Hydrochloric Acid SCHEMBL3044007 0.82 CXCR3 (0.56) CXCR3GCGRLMNAGAAHTT
SCHEMBL3274446 0.81 USP5 (0.47) CA1CA2CA9SMN1; SMN2ATM

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 3 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 disclosed
US-8481527-B2 Benzamide derivatives as bradykinin antagonists RICHTER GEDEON NYRT. (HU) 2013-07-09 US disclosed
US-20100087423-A1 NEW BENZAMIDE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-04-08 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 (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 CXCR3 566/4885KEAP1 675/4885NFE2L2 2470/4885

“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.