SCHEMBL13711652

SCHEMBL13711652

CCOC(=O)c1ccc(C)cc1N1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.54
PIK3CA P42336 1/20 0.52
LMNA P02545 4/20 0.52
L3MBTL1 Q9Y468 4/20 0.52
KMT2A Q03164 2/20 0.52
MAPT P10636 2/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
MEN1 O00255 1/20 0.52
MC4R P32245 1/20 0.52
HTT P42858 1/20 0.52
PTK2B Q14289 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 4/20 0.50
KDM4E B2RXH2 3/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
POLB P06746 2/20 0.49
OPRK1 P41145 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
SCHEMBL19676902 0.89 LMNA (0.60) GAAPIK3CALMNAL3MBTL1KMT2A
SCHEMBL25258059 0.87 GAA (0.53) GAAPIK3CALMNAL3MBTL1KMT2A
SCHEMBL4100817 0.87 GAA (0.53) GAAPIK3CALMNAL3MBTL1KMT2A
SCHEMBL18395032 0.87 KDM4E (0.53) GAAPIK3CALMNAL3MBTL1MAPT
SCHEMBL6644344 0.85 KMT2A (0.59) GAALMNAL3MBTL1KMT2AMAPT
SCHEMBL18395696 0.84 KDM4E (0.62) GAAPIK3CALMNAL3MBTL1MAPT
SCHEMBL6609202 0.83 GAA (0.59) GAAPIK3CALMNAL3MBTL1KMT2A
SCHEMBL4099074 0.83 KMT2A (0.64) LMNAL3MBTL1KMT2ASMN1; SMN2MEN1
SCHEMBL6647378 0.81 ALDH1A1 (0.52) GAALMNAKMT2AMAPTSMN1; SMN2
SCHEMBL28923550 0.80 LMNA (0.59) GAAPIK3CALMNAKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1882684-B1 PYRROLIDINE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC (JP) 2014-12-10 EP disclosed
US-7585886-B2 Pyrrolidine derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2009-09-08 US disclosed
US-20090062366-A1 Pyrrolidine derivative or salt thereof ASTELLAS PHARAMA INC. (JP) 2009-03-05 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-20090062366-A1 Pyrrolidine derivative or salt thereof CASR, CYP2R1, PTH1R GAA 601/4885PIK3CA 2212/4885LMNA 4308/4885

“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.