SCHEMBL4414434

SCHEMBL4414434

CCN(CC)C(=O)C1CCCN(C(=O)N2CCc3cc(OC)cc(OC)c3C2c2cccc(OC(F)(F)F)c2)C1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.39
KDM4E B2RXH2 4/20 0.38
HPGD P15428 1/20 0.38
ALDH1A1 P00352 2/20 0.38
MAPT P10636 1/20 0.38
GRIN2C Q14957 2/20 0.37
MTNR1B P49286 1/20 0.37
NAMPT P43490 1/20 0.37
HCRTR2 O43614 4/20 0.36
HCRTR1 O43613 3/20 0.36
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
LMNA P02545 1/20 0.36
BCL9 O00512 1/20 0.36
CTNNB1 P35222 1/20 0.36

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
SCHEMBL4422972 0.81 HCRTR2 (0.41) PDE4BGRIN2CMTNR1BHCRTR2
SCHEMBL4421033 0.80 MTNR1B (0.41) GRIN2CMTNR1BLMNA
SCHEMBL4423016 0.80 TRPV1 (0.40) PDE4BGRIN2CMTNR1BHCRTR2HCRTR1
SCHEMBL4418264 0.79 MTNR1B (0.52) GRIN2CMTNR1BHCRTR2HCRTR1LMNA
SCHEMBL4417027 0.79 MTNR1B (0.47) ALDH1A1GRIN2CMTNR1BHCRTR2HCRTR1
SCHEMBL4417009 0.78 PDE4B (0.42) PDE4BKDM4EALDH1A1GRIN2CMTNR1B
SCHEMBL4423019 0.77 HCRTR2 (0.38) PDE4BGRIN2CMTNR1BHCRTR2HCRTR1
SCHEMBL4423047 0.77 GRIN2C (0.51) MAPTGRIN2CMTNR1BLMNA
SCHEMBL4414983 0.77 GRIN2C (0.43) GRIN2CMTNR1BLMNA
SCHEMBL4416192 0.76 GRIN2C (0.47) MAPTGRIN2CMTNR1BLMNA

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
EP-1663983-B1 N-SUBSTITUTED, 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2009-01-21 EP disclosed
EP-1663983-B1 N-SUBSTITUTED, 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2009-01-21 EP disclosed
EP-1663983-A1 N-SUBSTITUTED, 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2006-06-07 EP disclosed
US-20050070570-A1 Novel potassium channels modulators 4SC AG (DE) 2005-03-31 US disclosed
WO-2004113302-A1 N-SUBSTITUTED 6,8-DIALKOXY-1,2,3,4-TETRAHYDRO-1H-ISOQUINOLINE AS POTASSIUM CHANNELS MODULATORS 4SC AG (DE) 2004-12-29 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-20050070570-A1 Novel potassium channels modulators HCN4, KCNA4, KCNN4 PDE4B 1553/4885KDM4E 811/4885HPGD 3561/4885

“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.