SCHEMBL7301666

SCHEMBL7301666

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

nearest known ligand 0.70

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PREP P48147 5/20 0.70
TSHR P16473 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
KDM4E B2RXH2 1/20 0.51
LMNA P02545 1/20 0.51
CTRB1 P17538 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
KMT2A Q03164 1/20 0.48
KLK7 P49862 1/20 0.48
KLK5 Q9Y337 1/20 0.48
ACE2 Q9BYF1 1/20 0.48
CTSK P43235 1/20 0.48
PRCP P42785 1/20 0.48
GFER P55789 1/20 0.48

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
SCHEMBL7301658 1.00 PREP (0.70) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL9872918 0.90 PREP (0.76) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL9872924 0.90 PREP (0.76) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL9872921 0.90 PREP (0.76) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL7302338 0.88 PREP (0.67) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL7302343 0.88 PREP (0.67) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL7300029 0.85 PREP (0.68) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL7300023 0.85 PREP (0.68) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL7299336 0.85 PREP (0.65) PREPTSHRL3MBTL1KDM4ELMNA
SCHEMBL7299331 0.85 PREP (0.65) PREPTSHRL3MBTL1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5506256-A PREVENTION AND/OR TREATMENT OF DEMENTIA, AMNESIA YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-04-09 US disclosed
EP-0468469-A2 Proline derivatives Japan Tobacco Inc. (JP) 1992-01-29 EP disclosed