SCHEMBL1720091

SCHEMBL1720091

O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2ccccc2)C1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 16/20 0.84
MEN1 O00255 1/20 0.84
KMT2A Q03164 1/20 0.84
HSD11B1 P28845 2/20 0.65
MAPT P10636 1/20 0.65

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
SCHEMBL21926389 0.92 MGLL (0.71) MGLLMEN1KMT2A
SCHEMBL21928862 0.92 MGLL (0.71) MGLLMEN1KMT2A
SCHEMBL6208966 0.92 MGLL (1.00) MGLLMEN1KMT2AHSD11B1MAPT
SCHEMBL1720910 0.92 MGLL (1.00) MGLLMEN1KMT2AHSD11B1MAPT
SCHEMBL1719734 0.91 MGLL (0.68) MGLLMEN1KMT2AHSD11B1
SCHEMBL5472341 0.88 MGLL (0.85) MGLLMEN1KMT2AHSD11B1
SCHEMBL5472343 0.88 MGLL (0.85) MGLLMEN1KMT2AHSD11B1
SCHEMBL1720591 0.86 HSD11B1 (0.84) MGLLMEN1KMT2AHSD11B1
SCHEMBL5476619 0.86 HSD11B1 (0.84) MGLLMEN1KMT2AHSD11B1
SCHEMBL1719576 0.83 MGLL (0.63) MGLLMEN1KMT2AHSD11B1MAPT

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-1566380-B1 ISOQUINOLINE COMPOUNDS AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2012-01-11 EP disclosed
US-7501412-B2 Isoquinoline compounds and medicinal use thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-03-10 US disclosed
US-20060094743-A1 Isoquinoline compounds and medicinal use thereof MITSUBISHI PHARMA CORPORATION (JP) 2006-05-04 US disclosed
EP-1566380-A1 ISOQUINOLINE COMPOUNDS AND MEDICINAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2005-08-24 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-20060094743-A1 Isoquinoline compounds and medicinal use thereof PARP1, NQO1, PARP3 MGLL 3022/4885MEN1 3125/4885KMT2A 1063/4885

“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.