SCHEMBL9564582

SCHEMBL9564582

C[C@H](O)NC(=O)[C@H]1CCCN1C(=O)OCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 1/20 0.70
NPSR1 Q6W5P4 1/20 0.63
TSHR P16473 3/20 0.62
KMT2A Q03164 2/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
KDM4E B2RXH2 1/20 0.62
LMNA P02545 1/20 0.62
GFER P55789 1/20 0.61
PREP P48147 1/20 0.61
ALDH1A1 P00352 2/20 0.60
TP53 P04637 1/20 0.59
MEN1 O00255 1/20 0.59
HSD17B10 Q99714 1/20 0.58
CTSK P43235 2/20 0.58
PRCP P42785 1/20 0.58
KDM1A O60341 1/20 0.57
RCOR1 Q9UKL0 1/20 0.57
CTSL P07711 1/20 0.57
CYP3A4 P08684 1/20 0.56
MAPT P10636 1/20 0.56

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
SCHEMBL7265570 1.00 CTRB1 (0.70) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL8247594 0.93 CTRB1 (0.73) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL8248799 0.93 CTRB1 (0.73) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL8395473 0.93 CTRB1 (0.73) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL31084237 0.90 CTRB1 (0.69) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL9243269 0.90 CTRB1 (0.69) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL9243277 0.90 CTRB1 (0.69) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL10934560 0.89 CTRB1 (0.68) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL12234861 0.89 CTRB1 (0.68) CTRB1NPSR1TSHRKMT2AL3MBTL1
SCHEMBL10940771 0.89 CTRB1 (0.68) CTRB1NPSR1TSHRKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0541497-A1 Prolineamide derivatives as enhancers of learning processes and memory and pharmaceutical compositions containing same Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 1993-05-12 EP claimed