SCHEMBL17475458

SCHEMBL17475458

Cc1cc(OCc2c(Cl)ccc(N(C)C(=O)CNC(=O)NCCCC(=O)O)c2C#N)c2ccccc2n1

nearest known ligand 0.73

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 11/20 0.45

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
SCHEMBL17475447 0.84 BDKRB2 (0.59) BDKRB2
SCHEMBL17475457 0.83 BDKRB2 (0.35) BDKRB2
SCHEMBL17475441 0.76 BDKRB2 (0.57) BDKRB2
SCHEMBL17475443 0.73 BDKRB2 (0.61) BDKRB2
SCHEMBL7747226 0.67 BDKRB2 (0.71) BDKRB2
SCHEMBL17475445 0.67 BDKRB2 (0.51) BDKRB2
Hydrochloric Acid SCHEMBL7747382 0.67 BDKRB2 (0.71) BDKRB2
SCHEMBL17475444 0.66 BDKRB2 (0.70) BDKRB2
SCHEMBL17475446 0.66 BDKRB2 (0.70) BDKRB2
SCHEMBL7749671 0.66 BDKRB2 (0.70) BDKRB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160030416-A1 METHODS OF TREATING B2-BRADYKININ RECEPTOR MEDIATED ANGIOEDEMA SHIRE HUMAN GENETIC THERAPIES, INC. 2016-02-04 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-20160030416-A1 METHODS OF TREATING B2-BRADYKININ RECEPTOR MEDIATED ANGIOEDEMA BDKRB2, BDKRB1, HRH2 BDKRB2 1/4885

“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.