SCHEMBL4431424

SCHEMBL4431424

[CH2]CC1CCN(C(=O)c2ccco2)CC1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.65
PKM P14618 1/20 0.65
LMNA P02545 1/20 0.62
ALDH1A1 P00352 7/20 0.60
NPC1 O15118 1/20 0.60
KDM4E B2RXH2 2/20 0.59
NPSR1 Q6W5P4 2/20 0.59
HTT P42858 1/20 0.59
MAPK1 P28482 1/20 0.57
RAB9A P51151 1/20 0.57
POLB P06746 2/20 0.56
PTPN2 P17706 1/20 0.55
PTPN1 P18031 1/20 0.55
TP53 P04637 1/20 0.55
TSHR P16473 1/20 0.55
KMT2A Q03164 1/20 0.54
RBP4 P02753 1/20 0.54

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
SCHEMBL7238822 0.85 ALDH1A1 (0.64) SMN1; SMN2PKMLMNAALDH1A1KDM4E
SCHEMBL25371656 0.84 SMN1; SMN2 (0.60) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL13597168 0.82 ALDH1A1 (0.60) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL16026437 0.82 ALDH1A1 (0.83) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL12593269 0.81 SMN1; SMN2 (0.68) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL27080814 0.81 SMN1; SMN2 (0.73) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL19834829 0.81 SMN1; SMN2 (0.60) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL1839628 0.80 SMN1; SMN2 (0.76) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL1727519 0.80 SMN1; SMN2 (0.59) SMN1; SMN2PKMLMNAALDH1A1NPC1
SCHEMBL1372144 0.79 ALDH1A1 (0.73) SMN1; SMN2PKMLMNAALDH1A1NPC1

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 SMN1; SMN2 4623/4885PKM 804/4885LMNA 1723/4885
US-20040147520-A1 Sulfonylquinoxalone acetamide derivatives and related compounds as bradykinin antagonists BDKRB2, BDKRB1, PDXK SMN1; SMN2 4598/4885PKM 1258/4885LMNA 1922/4885

“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.