SCHEMBL2836833

SCHEMBL2836833

CCOc1cc2c(cc1OCC)C[N]CC2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 2/20 0.40
ACHE P22303 2/20 0.39
MAPT P10636 5/20 0.35
KDM4E B2RXH2 5/20 0.35
GAA P10253 2/20 0.35
ABCC4 O15439 1/20 0.35
ABCB11 O95342 1/20 0.35
CHRM2 P08172 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
PTGS1 P23219 1/20 0.35
PDE4A P27815 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 2/20 0.35
TSHR P16473 2/20 0.34
CYP3A4 P08684 1/20 0.34
MAPK1 P28482 2/20 0.34

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
SCHEMBL9404846 0.86 ACHE (0.44) PDE4DACHEMAPTKDM4EGAA
SCHEMBL443555 0.79 MAOA (0.50) PDE4DMAPTKDM4EGAASLC6A4
SCHEMBL2912990 0.76 MAPT (0.48) PDE4DACHEMAPTKDM4EGAA
SCHEMBL9573042 0.71 ACHE (0.41) PDE4DACHEMAPTKDM4EGAA
SCHEMBL24465258 0.71 MAPT (0.52) PDE4DACHEMAPTKDM4EGAA
SCHEMBL22028118 0.71 MAPT (0.52) PDE4DACHEMAPTKDM4EGAA
SCHEMBL6905568 0.71 MAPT (0.52) PDE4DACHEMAPTKDM4EGAA
Hydrochloric Acid SCHEMBL11547300 0.70 ACHE (0.40) PDE4DACHEMAPTKDM4EGAA
SCHEMBL10709911 0.70 MAOA (0.68) PDE4DACHEMAPTKDM4EGAA
SCHEMBL8543417 0.67 MAOA (0.55) PDE4DMAPTKDM4EGAASLC6A4

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-20100216790-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2010-08-26 US disclosed
US-7709488-B2 Imidazopyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG (DE) 2010-05-04 US disclosed
EP-1670796-B1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS NYCOMED GMBH (DE) 2008-06-25 EP disclosed
US-20080021039-A1 Imidazopyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG 2008-01-24 US disclosed
US-7279488-B2 Imidazopyridine-derivatives as inducible no-synthase inhibitors NYCOMED GMBH (DE) 2007-10-09 US disclosed
US-20060293302-A1 Imidazopyridine-derivatives as inducible no-synthase inhibitors ALTANA PHARMA AG (DE) 2006-12-28 US disclosed
EP-1670796-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA Pharma AG (DE) 2006-06-21 EP disclosed
WO-2005030770-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS ALTANA PHARMA AG (DE) 2005-04-07 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 (3 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-20060293302-A1 Imidazopyridine-derivatives as inducible no-synthase inhibitors NOS2, NOS1, NOS3 PDE4D 488/4885ACHE 376/4885MAPT 4138/4885
US-20080021039-A1 Imidazopyridine-derivatives as inducible no-synthase inhibitors NOS2, NOS1, NOS3 PDE4D 488/4885ACHE 376/4885MAPT 4138/4885
US-20100216790-A1 IMIDAZOPYRIDINE-DERIVATIVES AS INDUCIBLE NO-SYNTHASE INHIBITORS NOS2, NOS1, NOS3 PDE4D 488/4885ACHE 376/4885MAPT 4138/4885

“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.