SCHEMBL4413383

SCHEMBL4413383

COc1cc2c(c(OC)c1)C(c1cc(F)c(F)c(OC)c1F)N(C(=O)c1ccc(NC(C)=O)cc1)CC2

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.47
MEN1 O00255 3/20 0.47
CA12 O43570 4/20 0.44
CA1 P00915 4/20 0.44
CA2 P00918 4/20 0.44
CA7 P43166 4/20 0.44
CA9 Q16790 4/20 0.44
CA14 Q9ULX7 4/20 0.44
GRIN2C Q14957 4/20 0.44
TP53 P04637 2/20 0.42
DRD2 P14416 1/20 0.42
DRD1 P21728 1/20 0.42
MTNR1B P49286 1/20 0.42
PKM P14618 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
LMNA P02545 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
SCHEMBL4413378 0.77 KMT2A (0.45) KMT2AMEN1CA12CA1CA2
SCHEMBL13809246 0.73 GRIN2C (0.51) KMT2AMEN1CA12CA1CA2
SCHEMBL4414980 0.71 KMT2A (0.60) KMT2AMEN1CA12CA1CA2
SCHEMBL13973316 0.71 CA1 (0.50) KMT2AMEN1CA1CA2CA7
SCHEMBL13809247 0.70 GRIN2C (0.49) KMT2AMEN1CA12CA1CA2
SCHEMBL13809227 0.69 GRIN2C (0.43) KMT2AMEN1CA12CA1CA2
SCHEMBL4414665 0.69 GRIN2C (0.64) KMT2AMEN1GRIN2CTP53MTNR1B
SCHEMBL4552564 0.69 GRIN2C (0.64) KMT2AMEN1CA12CA1CA2
SCHEMBL4421006 0.69 ABCG2 (0.51) KMT2AMEN1CA12CA1CA2
SCHEMBL4416765 0.68 KMT2A (0.51) KMT2AMEN1CA12CA1CA2

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 KMT2A 1243/4885MEN1 4033/4885CA12 2330/4885

“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.