SCHEMBL4414665

SCHEMBL4414665

COc1ccc(C(=O)N2CCc3cc(OC)cc(OC)c3C2C)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRIN2C Q14957 6/20 0.64
KMT2A Q03164 5/20 0.57
MEN1 O00255 3/20 0.57
TP53 P04637 3/20 0.52
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
MTNR1B P49286 1/20 0.50
FKBP1A P62942 1/20 0.50
LMNA P02545 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL4416142 0.90 GRIN2C (0.55) GRIN2CKMT2AMEN1TP53MTNR1B
SCHEMBL4414980 0.83 KMT2A (0.60) GRIN2CKMT2AMEN1TP53MTNR1B
SCHEMBL4424375 0.81 HTT (0.71) GRIN2CKMT2AMAPTMTNR1BLMNA
SCHEMBL4552564 0.81 GRIN2C (0.64) GRIN2CKMT2AMEN1TP53MTNR1B
SCHEMBL7899470 0.79 GRIN2C (1.00) GRIN2CTP53
SCHEMBL4416149 0.77 MTNR1B (0.45) GRIN2CKMT2AMEN1TP53MTNR1B
SCHEMBL4413447 0.76 KMT2A (0.55) GRIN2CKMT2AMEN1TP53LMNA
SCHEMBL4416765 0.75 KMT2A (0.51) GRIN2CKMT2AMEN1KDM4EALDH1A1
SCHEMBL4423052 0.75 GRIN2C (0.57) GRIN2CKMT2AMEN1MTNR1BLMNA
SCHEMBL4418256 0.74 KMT2A (0.52) GRIN2CKMT2AMEN1MAPTLMNA

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-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 GRIN2C 567/4885KMT2A 1243/4885MEN1 4033/4885

“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.