SCHEMBL4423019

SCHEMBL4423019

COc1cc2c(c(OC)c1)C(c1cccc(OC(F)(F)F)c1)N(C(=O)N1CCCC3CCCC=C31)CC2

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 7/20 0.38
MTNR1B P49286 1/20 0.37
GRIN2C Q14957 3/20 0.36
TRPV1 Q8NER1 2/20 0.36
FKBP1A P62942 1/20 0.35
HCRTR1 O43613 4/20 0.35
PDE4B Q07343 1/20 0.35
PDE4D Q08499 1/20 0.35
MAPK7 Q13164 1/20 0.35

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 0.83 HCRTR2 (0.41) HCRTR2MTNR1BGRIN2CTRPV1PDE4B
SCHEMBL4423016 0.83 TRPV1 (0.40) HCRTR2MTNR1BGRIN2CTRPV1FKBP1A
SCHEMBL4417027 0.82 MTNR1B (0.47) HCRTR2MTNR1BGRIN2CTRPV1HCRTR1
SCHEMBL4418264 0.82 MTNR1B (0.52) HCRTR2MTNR1BGRIN2CTRPV1HCRTR1
SCHEMBL4421033 0.80 MTNR1B (0.41) MTNR1BGRIN2CTRPV1MAPK7
SCHEMBL4423047 0.80 GRIN2C (0.51) MTNR1BGRIN2CMAPK7
SCHEMBL4413447 0.79 KMT2A (0.55) GRIN2CPDE4BPDE4D
SCHEMBL4416192 0.79 GRIN2C (0.47) MTNR1BGRIN2CMAPK7
SCHEMBL4418256 0.79 KMT2A (0.52) GRIN2CPDE4BPDE4D
SCHEMBL4417009 0.78 PDE4B (0.42) HCRTR2MTNR1BGRIN2CTRPV1FKBP1A

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 4 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-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 HCRTR2 218/4885MTNR1B 569/4885GRIN2C 567/4885

“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.