SCHEMBL4423041

SCHEMBL4423041

COc1cccc(C(=O)N2CCc3cc(OC)cc(OC)c3C2c2ccc(O)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2C Q14957 6/20 0.54
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TP53 P04637 2/20 0.48
MTNR1B P49286 1/20 0.46
ABCG2 Q9UNQ0 1/20 0.46
PDE4B Q07343 1/20 0.45

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
SCHEMBL4412546 0.92 GRIN2C (0.49) GRIN2CCA12CA1CA2CA7
SCHEMBL4416858 0.89 GRIN2C (0.56) GRIN2CCA12CA1CA2CA7
SCHEMBL4414980 0.89 KMT2A (0.60) GRIN2CCA12CA1CA2CA7
SCHEMBL4423052 0.86 GRIN2C (0.57) GRIN2CCA12CA1CA2CA7
SCHEMBL4416765 0.84 KMT2A (0.51) GRIN2CCA12CA1CA2CA7
SCHEMBL4423047 0.84 GRIN2C (0.51) GRIN2CCA12CA1CA2CA7
SCHEMBL4425798 0.84 KIF11 (0.49) GRIN2CCA12CA1CA2CA7
SCHEMBL4421006 0.83 ABCG2 (0.51) GRIN2CCA12CA1CA2CA7
SCHEMBL4422963 0.83 GRIN2C (0.47) GRIN2CCA12CA1CA2CA7
SCHEMBL6505155 0.82 GRIN2C (0.53) GRIN2CMEN1KMT2AMTNR1B

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-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
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 GRIN2C 567/4885CA12 2330/4885CA1 2370/4885

“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.