SCHEMBL4423209

SCHEMBL4423209

COc1cc2c(c(OC)c1)C(c1cccc(OC(F)(F)F)c1)N(C(=O)c1c(C)noc1-c1cc(C)on1)CC2

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.37
NPC1 O15118 1/20 0.37
GRIN2C Q14957 3/20 0.36
HCRTR1 O43613 1/20 0.36
HCRTR2 O43614 1/20 0.36
NR1I2 O75469 2/20 0.36
MTNR1B P49286 1/20 0.35
RXFP1 Q9HBX9 2/20 0.35
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
SCD5 Q86SK9 1/20 0.34
POLB P06746 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34
LMNA P02545 1/20 0.34
MAPK7 Q13164 1/20 0.33
ROCK2 O75116 1/20 0.33
FLT1 P17948 1/20 0.33

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
SCHEMBL4415224 0.89 TSHR (0.40) GRIN2CMTNR1BKMT2AMEN1SCD5
SCHEMBL13973322 0.82 RXFP1 (0.32) L3MBTL1HCRTR1HCRTR2RXFP1
SCHEMBL4416972 0.81 GRIN2C (0.41) GRIN2CHCRTR1HCRTR2MTNR1BKMT2A
SCHEMBL4423047 0.80 GRIN2C (0.51) GRIN2CMTNR1BKMT2AMEN1NPSR1
SCHEMBL4416192 0.79 GRIN2C (0.47) GRIN2CMTNR1BKMT2AMEN1NPSR1
SCHEMBL4413447 0.79 KMT2A (0.55) GRIN2CKMT2AMEN1NPSR1LMNA
SCHEMBL4418256 0.79 KMT2A (0.52) GRIN2CKMT2AMEN1NPSR1LMNA
SCHEMBL6505108 0.79 GRIN2C (0.40) L3MBTL1GRIN2CMTNR1BKMT2AMEN1
SCHEMBL4417027 0.79 MTNR1B (0.47) HTTNPC1GRIN2CHCRTR1HCRTR2
SCHEMBL4418264 0.79 MTNR1B (0.52) GRIN2CHCRTR1HCRTR2MTNR1BKMT2A

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 2 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
US-20050070570-A1 Novel potassium channels modulators 4SC AG (DE) 2005-03-31 US 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 HTT 1037/4885L3MBTL1 2533/4885NPC1 1738/4885

“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.