SCHEMBL470960

SCHEMBL470960

COCCCN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.40
SETD7 Q8WTS6 1/20 0.40
NR1H2 P55055 1/20 0.39
MEN1 O00255 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
GPR119 Q8TDV5 6/20 0.37
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
SCN1A P35498 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37

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
SCHEMBL28694792 1.00 DRD3 (0.40) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL15217027 1.00 DRD3 (0.40) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL471005 0.96 DRD3 (0.40) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL15217026 0.96 DRD3 (0.40) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL28691426 0.92 DRD3 (0.44) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL30616338 0.92 DRD3 (0.44) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL13568017 0.86 NR1H2 (0.43) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL13567959 0.86 NR1H2 (0.43) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL23867140 0.85 NR1H2 (0.43) DRD3SETD7NR1H2MEN1ALDH1A1
SCHEMBL3965451 0.85 SMARCA2 (0.41) SETD7NR1H2MEN1ALDH1A1MAPT

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2615089-B1 Pyrazoloquinoline compounds ASTELLAS PHARMA INC (JP) 2016-04-27 EP disclosed
US-8822448-B2 Pyrazoloquinoline compound ASTELLAS PHARMA INC. (JP) 2014-09-02 US disclosed
US-8822448-B2 Pyrazoloquinoline compound ASTELLAS PHARMA INC. (JP) 2014-09-02 US disclosed
US-20130225553-A1 PYRAZOLOQUINOLINE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-08-29 US disclosed
US-20130225553-A1 PYRAZOLOQUINOLINE COMPOUND ASTELLAS PHARMA INC. (JP) 2013-08-29 US disclosed
EP-2615089-A1 PYRAZOLOQUINOLINE COMPOUND Astellas Pharma Inc. (JP) 2013-07-17 EP disclosed
WO-2012033144-A1 PYRAZOLOQUINOLINE COMPOUND アステラス製薬株式会社 (JP) 2012-03-15 WO 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-20130225553-A1 PYRAZOLOQUINOLINE COMPOUND PDE9A, PDE5A, PDE2A DRD3 4122/4885SETD7 2789/4885NR1H2 4325/4885

“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.