SCHEMBL15217031

SCHEMBL15217031

CCOCCCCN1CCN(C(=O)OC(C)(C)C)C[C@H]1C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
SETD7 Q8WTS6 1/20 0.38
GPR119 Q8TDV5 9/20 0.38
CYP2D6 P10635 1/20 0.37
CYP2C19 P33261 1/20 0.37
NR1H2 P55055 1/20 0.36
DRD3 P35462 1/20 0.36
HPGD P15428 1/20 0.36

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
SCHEMBL15217032 1.00 MEN1 (0.39) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL471005 0.88 DRD3 (0.40) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL15217026 0.88 DRD3 (0.40) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL23867140 0.85 NR1H2 (0.43) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL28950964 0.85 NR1H2 (0.43) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL28694792 0.84 DRD3 (0.40) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL15217027 0.84 DRD3 (0.40) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL470960 0.84 DRD3 (0.40) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL13568017 0.83 NR1H2 (0.43) MEN1ALDH1A1MAPTKMT2ASETD7
SCHEMBL13567959 0.83 NR1H2 (0.43) MEN1ALDH1A1MAPTKMT2ASETD7

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
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

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 MEN1 4011/4885ALDH1A1 381/4885MAPT 914/4885

“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.