SCHEMBL5509037

SCHEMBL5509037

Nc1ccc(NC(=O)Nc2ccc(-c3ccc(C(=O)O)o3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.56
RAB9A P51151 1/20 0.56
ALDH1A1 P00352 1/20 0.55
HPGD P15428 1/20 0.55
PTPN1 P18031 3/20 0.49
PTPN11 Q06124 1/20 0.49
KDM4E B2RXH2 2/20 0.48
LMNA P02545 1/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
JAK2 O60674 1/20 0.47
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
PSMD14 O00487 1/20 0.45
MMP2 P08253 1/20 0.45
PTPN7 P35236 1/20 0.45
DUSP3 P51452 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CA12 O43570 1/20 0.45

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
SCHEMBL5510635 0.88 ALDH1A1 (0.68) MAPTRAB9AALDH1A1HPGDPTPN1
SCHEMBL3418331 0.87 ALDH1A1 (0.70) ALDH1A1HPGDPTPN1PTPN11KDM4E
SCHEMBL3904837 0.87 PTPN1 (0.67) MAPTALDH1A1HPGDPTPN1PTPN11
SCHEMBL3900126 0.85 KMT2A (0.57) MAPTRAB9AALDH1A1HPGDPTPN1
SCHEMBL3896317 0.83 ALDH1A1 (0.60) MAPTALDH1A1HPGDPTPN1PTPN11
SCHEMBL5510786 0.81 MEN1 (0.69) MAPTRAB9AALDH1A1HPGDLMNA
SCHEMBL11457930 0.80 MEN1 (0.61) MAPTRAB9AALDH1A1HPGDPTPN1
SCHEMBL5512059 0.80 ALDH1A1 (0.53) MAPTALDH1A1HPGDPTPN1PTPN11
SCHEMBL1772679 0.79 ALDH1A1 (0.84) ALDH1A1HPGDPTPN1PTPN11KDM4E
SCHEMBL4874209 0.78 ALDH1A1 (0.54) MAPTRAB9AALDH1A1HPGDPTPN1

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-20070203117-A1 modulators of nicotinic and/or of monoamine receptors; as diagnostic tools or monitoring agents; for in vivo neuroimaging in labeled/unlabelled forms; inflammation, pain, neurodegenerative disorders; cholinergic ligands;5-(4-Benzoylamino-phenyl)-furan-2-carboxylic acid(1-aza-bicyclo[2.2.2]oct-3-yl)-amide NEUROSEARCH A/S (DK) 2007-08-30 US claimed
EP-1751150-A2 NOVEL AZABICYCLIC ARYL DERIVATIVES NEUROSEARCH A/S (DK) 2007-02-14 EP claimed
WO-2005111033-A2 NOVEL AZABICYCLIC ARYL DERIVATIVES NEUROSEARCH A/S (DK) 2005-11-24 WO claimed
US-20070203117-A1 modulators of nicotinic and/or of monoamine receptors; as diagnostic tools or monitoring agents; for in vivo neuroimaging in labeled/unlabelled forms; inflammation, pain, neurodegenerative disorders; cholinergic ligands;5-(4-Benzoylamino-phenyl)-furan-2-carboxylic acid(1-aza-bicyclo[2.2.2]oct-3-yl)-amide NEUROSEARCH A/S (DK) 2007-08-30 US disclosed
EP-1751150-A2 NOVEL AZABICYCLIC ARYL DERIVATIVES NEUROSEARCH A/S (DK) 2007-02-14 EP disclosed
WO-2005111033-A2 NOVEL AZABICYCLIC ARYL DERIVATIVES NEUROSEARCH A/S (DK) 2005-11-24 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-20070203117-A1 modulators of nicotinic and/or of monoamine receptors; as diagnostic tools or monitoring agents; for in vivo neuroimaging in labeled/unlabelled forms; inflammation, pain, neurodegenerative disorders; cholinergic ligands;5-(4-Benzoylamino-phenyl)-furan-2-carboxylic acid(1-aza-bicyclo[2.2.2]oct-3-yl)-amide CHRNA5, CHRNA2, CHRNA6 MAPT 1063/4885RAB9A 3434/4885ALDH1A1 923/4885

“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.