SCHEMBL4716223

SCHEMBL4716223

O=C(c1cccc(N2Cc3cccc(Cl)c3C2=O)c1)N1CCN(c2ncccn2)CC1

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 1/20 0.67
KDM4E B2RXH2 4/20 0.58
KMT2A Q03164 2/20 0.53
MEN1 O00255 1/20 0.53
SLC6A7 Q99884 7/20 0.52
ALDH1A1 P00352 2/20 0.50
LMNA P02545 2/20 0.50
HPGD P15428 1/20 0.50
SLC6A3 Q01959 1/20 0.48
RECQL P46063 1/20 0.48
POLB P06746 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL4711496 0.90 BDKRB1 (0.65) BDKRB1KDM4EKMT2AMEN1ALDH1A1
SCHEMBL4759441 0.88 BDKRB1 (0.84) BDKRB1KDM4EKMT2AMEN1ALDH1A1
SCHEMBL4716862 0.84 BDKRB1 (0.64) BDKRB1KMT2AMEN1ALDH1A1LMNA
SCHEMBL4760693 0.83 BDKRB1 (0.66) BDKRB1ALDH1A1LMNAHPGDSMN1; SMN2
SCHEMBL5630506 0.83 BDKRB1 (0.61) BDKRB1KDM4EKMT2AMEN1ALDH1A1
SCHEMBL4716396 0.82 BDKRB1 (0.61) BDKRB1KMT2AMEN1POLB
SCHEMBL4716232 0.81 BDKRB1 (0.56) BDKRB1KMT2AMEN1ALDH1A1LMNA
SCHEMBL1712902 0.81 BDKRB1 (1.00) BDKRB1KMT2AMEN1ALDH1A1HPGD
SCHEMBL5629162 0.81 BDKRB1 (0.78) BDKRB1KDM4EKMT2AMEN1ALDH1A1
SCHEMBL4714259 0.80 BDKRB1 (0.60) BDKRB1KDM4EKMT2AMEN1ALDH1A1

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 1/4885KDM4E 4606/4885KMT2A 4091/4885

“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.