SCHEMBL1719936

SCHEMBL1719936

CCOC(=O)N1CCC(C(=O)OC)C1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.65
THRB P10828 1/20 0.54
ATM Q13315 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
ALDH1A1 P00352 7/20 0.53
MAPT P10636 3/20 0.51
CHRM1 P11229 1/20 0.50
POLB P06746 1/20 0.49
HTT P42858 2/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PKM P14618 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
SCHEMBL1720711 0.90 GAA (0.73) GAATHRBATML3MBTL1SMN1; SMN2
SCHEMBL9675422 0.90 ALDH1A1 (0.64) GAATHRBATML3MBTL1ALDH1A1
SCHEMBL9675197 0.86 SMN1; SMN2 (0.59) GAAL3MBTL1SMN1; SMN2ALDH1A1POLB
SCHEMBL9214032 0.83 GAA (0.62) GAATHRBATML3MBTL1SMN1; SMN2
SCHEMBL11936428 0.81 SMN1; SMN2 (0.54) GAAL3MBTL1SMN1; SMN2ALDH1A1POLB
SCHEMBL3055942 0.81 GAA (0.60) GAATHRBATML3MBTL1SMN1; SMN2
SCHEMBL6215242 0.80 ALDH1A1 (0.71) SMN1; SMN2ALDH1A1POLBHTT
SCHEMBL631512 0.79 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1MAPTHTTKMT2A
SCHEMBL16025051 0.79 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1MAPTHTTKMT2A
SCHEMBL14348062 0.79 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1MAPTHTTKMT2A

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 GAA 505/4885THRB 4727/4885ATM 1084/4885

“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.