SCHEMBL4718635

SCHEMBL4718635

O=C(c1cccc(N2Cc3cccc(Cl)c3C2=O)c1)N1CCN(C2CCCCC2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 1/20 0.59
L3MBTL1 Q9Y468 4/20 0.56
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.56
HTT P42858 1/20 0.51
POLB P06746 1/20 0.49
L3MBTL3 Q96JM7 3/20 0.48
NAMPT P43490 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
LRRK2 Q5S007 1/20 0.44
MBTD1 Q05BQ5 1/20 0.43
EGFR P00533 2/20 0.43
HRH3 Q9Y5N1 1/20 0.43

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
SCHEMBL4714572 0.92 BDKRB1 (0.59) BDKRB1L3MBTL1L3MBTL3MEN1KMT2A
SCHEMBL4714598 0.91 BDKRB1 (0.58) BDKRB1L3MBTL1KDM4EALDH1A1L3MBTL3
SCHEMBL5628617 0.87 BDKRB1 (0.57) BDKRB1L3MBTL1L3MBTL3MEN1KMT2A
SCHEMBL4714381 0.86 BDKRB1 (0.55) BDKRB1L3MBTL1KDM4EALDH1A1L3MBTL3
SCHEMBL4713388 0.86 BDKRB1 (0.56) BDKRB1L3MBTL1KDM4EALDH1A1NAMPT
SCHEMBL4716862 0.85 BDKRB1 (0.64) BDKRB1L3MBTL1ALDH1A1L3MBTL3MEN1
SCHEMBL4712254 0.83 BDKRB1 (0.53) BDKRB1L3MBTL1L3MBTL3MEN1KMT2A
SCHEMBL4760693 0.83 BDKRB1 (0.66) BDKRB1ALDH1A1HTTEGFR
SCHEMBL5630639 0.82 BDKRB1 (0.61) BDKRB1L3MBTL3EGFR
SCHEMBL4714835 0.82 BDKRB1 (0.60) BDKRB1L3MBTL1L3MBTL3MBTD1EGFR

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-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 US claimed
EP-1877401-A2 NOVEL COMPOUNDS USEFUL FOR BRADYKININ B1 RECEPTOR ANTAGONISM Elan Pharmaceuticals Inc. (US) 2008-01-16 EP disclosed
US-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 US disclosed
US-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 US disclosed
US-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 US disclosed
WO-2006113140-A2 NOVEL COMPOUNDS USEFUL FOR BRADYKININ B1 RECEPTOR ANTAGONISM ELAN PHARMACEUTICALS, INC. (US) 2006-10-26 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 (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-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism BDKRB1, BDKRB2, NPBWR1 BDKRB1 1/4885L3MBTL1 430/4885KDM4E 4606/4885

“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.