SCHEMBL4413283

SCHEMBL4413283

COc1cc2c(c(OC)c1)C(c1ccc(O)cc1)N(C(=O)C1CCCC1)CC2

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 5/20 0.46
GRIN2C Q14957 3/20 0.44
PARP1 P09874 1/20 0.44
FKBP1A P62942 5/20 0.42
TRPV1 Q8NER1 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD11B1 P28845 1/20 0.40

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
SCHEMBL4552686 0.99 MTNR1B (0.45) MTNR1BGRIN2CPARP1FKBP1ATRPV1
SCHEMBL13972859 0.99 MTNR1B (0.45) MTNR1BGRIN2CPARP1FKBP1ATRPV1
SCHEMBL4423040 0.83 LMNA (0.51) MTNR1BGRIN2CPARP1FKBP1A
SCHEMBL4413412 0.82 LMNA (0.51) MTNR1BGRIN2CPARP1FKBP1A
SCHEMBL4414980 0.82 KMT2A (0.60) MTNR1BGRIN2CFKBP1AMEN1KMT2A
SCHEMBL4423041 0.80 GRIN2C (0.54) MTNR1BGRIN2CMEN1KMT2A
SCHEMBL4416765 0.78 KMT2A (0.51) MTNR1BGRIN2CMEN1KMT2A
SCHEMBL6505155 0.78 GRIN2C (0.53) MTNR1BGRIN2CFKBP1AMEN1KMT2A
SCHEMBL4423052 0.78 GRIN2C (0.57) MTNR1BGRIN2CMEN1KMT2A
SCHEMBL13972856 0.78 GRIN2C (0.53) MTNR1BGRIN2CFKBP1AMEN1KMT2A

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 3 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
EP-1489071-A1 N-substituted, 3,4-dihydro-1H-isoquinoline as potassium channels modulators 4SC AG (DE) 2004-12-22 EP 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 MTNR1B 569/4885GRIN2C 567/4885PARP1 4676/4885

“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.