SCHEMBL4150130

SCHEMBL4150130

C=CCNCc1ccc2c(c1)OCCC2N

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.38
ALKBH5 Q6P6C2 1/20 0.34
FTO Q9C0B1 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
NPY5R Q15761 1/20 0.32
HTR1A P08908 1/20 0.32
BDKRB1 P46663 2/20 0.32
MAP3K14 Q99558 1/20 0.31
KDM1A O60341 2/20 0.31
MAOA P21397 2/20 0.31
MAOB P27338 2/20 0.31
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL4142908 0.82 NPY5R (0.47) ALKBH5FTONPY5RHTR1ABDKRB1
SCHEMBL4155517 0.80 ALKBH5 (0.34) ALKBH5FTONPY5RHTR1ABDKRB1
SCHEMBL4148884 0.79 CYP3A4 (0.41) CYP3A4BDKRB1KDM1AMAOAMAOB
SCHEMBL4149466 0.78 BDKRB1 (0.37) ALKBH5FTOMAPTNPY5RHTR1A
SCHEMBL4134116 0.78 BDKRB1 (0.43) ALKBH5HTR1ABDKRB1
SCHEMBL4808441 0.77 ATM (0.55) KDM4EALDH1A1
SCHEMBL4145157 0.77 ALDH1A1 (0.41) ALKBH5FTOHTR1ABDKRB1KDM4E
SCHEMBL4145560 0.77 NPY5R (0.35) NPY5RHTR1ABDKRB1KDM4E
SCHEMBL4150330 0.76 HRH3 (0.42) CYP3A4BDKRB1KDM1AMAOAMAOB
SCHEMBL5951049 0.76 BDKRB1 (0.44) BDKRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048224-A1 COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2009-02-19 US disclosed
US-7425631-B2 Compounds and methods of use AMGEN INC. (US) 2008-09-16 US disclosed
EP-1631542-A1 BICYCLIC COMPOUNDS HAVING BRADYKININ RECEPTORS AFFINITY AND PHARMACEUTICAL COMPOSITIONS THEREOF Amgen, Inc. (US) 2006-03-08 EP disclosed
US-20050124654-A1 Compounds and methods of use AMGEN INC. 2005-06-09 US disclosed
WO-2004092116-A1 BICYCLIC COMPOUNDS HAVING BRADYKININ RECEPTORS AFFINITY AND PHARMACEUTICAL COMPOSITIONS THEREOF AMGEN, INC. (US) 2004-10-28 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 (2 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-20050124654-A1 Compounds and methods of use LTC4S, PTGES, LTB4R2 DPP7 485/4885ALKBH5 1697/4885FTO 2580/4885
US-20090048224-A1 COMPOUNDS AND METHODS OF USE LTC4S, PTGES, LTB4R2 DPP7 485/4885ALKBH5 1697/4885FTO 2580/4885

“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.