SCHEMBL4429944

SCHEMBL4429944

[CH2]CC1CCN(C(=O)Cc2ccccc2)CC1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.68
TACR3 P29371 1/20 0.67
HDAC3 O15379 1/20 0.60
HDAC4 P56524 1/20 0.60
HDAC1 Q13547 1/20 0.60
HDAC7 Q8WUI4 1/20 0.60
HDAC2 Q92769 1/20 0.60
HDAC10 Q969S8 1/20 0.60
HDAC11 Q96DB2 1/20 0.60
HDAC8 Q9BY41 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
HDAC9 Q9UKV0 1/20 0.60
HDAC5 Q9UQL6 1/20 0.60
ALDH1A1 P00352 6/20 0.58
KDM4E B2RXH2 3/20 0.58
POLB P06746 1/20 0.58
USP2 O75604 1/20 0.56
GAA P10253 1/20 0.56
HSD11B1 P28845 1/20 0.55
MEN1 O00255 1/20 0.53

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
SCHEMBL23682656 0.86 TACR3 (0.83) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL12424606 0.84 L3MBTL1 (0.68) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL22657574 0.84 L3MBTL1 (0.71) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL18106966 0.83 HDAC3 (0.66) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL27547326 0.82 L3MBTL1 (0.79) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL13181132 0.82 HDAC3 (0.68) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL13152714 0.82 L3MBTL1 (0.64) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL12677011 0.82 HDAC3 (0.64) L3MBTL1TACR3HDAC3HDAC4HDAC1
SCHEMBL10722408 0.81 HSD11B1 (0.77) L3MBTL1ALDH1A1KDM4EUSP2GAA
SCHEMBL3967794 0.81 HSD11B1 (0.77) L3MBTL1ALDH1A1KDM4EUSP2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7183281-B2 Sulfonylquinoxalone derivatives and related compounds as bradykinin antagonists ELAN PHARMACEUTICALS, INC. (US) 2007-02-27 US claimed
US-20040147520-A1 Sulfonylquinoxalone acetamide derivatives and related compounds as bradykinin antagonists ELAN PHARMACEUTICALS, INC. 2004-07-29 US claimed
US-7635775-B2 Sulfonylquinoxalone derivatives and related compounds as bradykinin antagonists ELAN PHARMACEUTICALS, INC. (US) 2009-12-22 US disclosed
US-7183281-B2 Sulfonylquinoxalone derivatives and related compounds as bradykinin antagonists ELAN PHARMACEUTICALS, INC. (US) 2007-02-27 US disclosed
US-20060293332-A1 Sulfonylquinoxalone derivatives and related compounds as bradykinin antagonists ELAN PHARMACEUTICALS, INC. 2006-12-28 US disclosed
EP-1501807-A1 SULFONYLQUINOXALONE ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ ANTAGONISTS Elan Pharmaceuticals, Inc. (US) 2005-02-02 EP disclosed
US-20040147520-A1 Sulfonylquinoxalone acetamide derivatives and related compounds as bradykinin antagonists ELAN PHARMACEUTICALS, INC. 2004-07-29 US disclosed
WO-2003093245-A1 SULFONYLQUINOXALONE ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BRADYKININ ANTAGONISTS ELAN PHARMACEUTICALS, INC. (US) 2003-11-13 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-20060293332-A1 Sulfonylquinoxalone derivatives and related compounds as bradykinin antagonists BDKRB2, BDKRB1, PDXK L3MBTL1 4404/4885TACR3 197/4885HDAC3 1900/4885
US-20040147520-A1 Sulfonylquinoxalone acetamide derivatives and related compounds as bradykinin antagonists BDKRB2, BDKRB1, PDXK L3MBTL1 4615/4885TACR3 226/4885HDAC3 1524/4885

“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.