SCHEMBL7852093

SCHEMBL7852093

CC(C)(C)OC(=O)N[C@H]1CN(Cc2ccccc2)C2CCOC21

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
KLK5 Q9Y337 3/20 0.40
KLK7 P49862 3/20 0.40
KDM1A O60341 1/20 0.40
MAOB P27338 1/20 0.40
PDE4B Q07343 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KCNA3 P22001 1/20 0.38
SCD O00767 1/20 0.37
MAPT P10636 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
ACE P12821 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
SCHEMBL7852091 1.00 KMT2A (0.50) KMT2AL3MBTL1KLK5KLK7KDM1A
SCHEMBL8176595 1.00 KMT2A (0.50) KMT2AL3MBTL1KLK5KLK7KDM1A
SCHEMBL7853125 0.95 KMT2A (0.52) KMT2AL3MBTL1KLK5KLK7KDM1A
SCHEMBL8185508 0.95 KMT2A (0.52) KMT2AL3MBTL1KLK5KLK7KDM1A
SCHEMBL7852771 0.95 KMT2A (0.52) KMT2AL3MBTL1KLK5KLK7KDM1A
SCHEMBL8177515 0.95 KMT2A (0.52) KMT2AL3MBTL1KLK5KLK7KDM1A
SCHEMBL7852770 0.95 KMT2A (0.52) KMT2AL3MBTL1KLK5KLK7KDM1A
SCHEMBL7847732 0.86 KMT2A (0.39) KMT2AL3MBTL1SCDMAPT
SCHEMBL8183263 0.86 KMT2A (0.39) KMT2AL3MBTL1SCDMAPT
SCHEMBL7852322 0.86 KMT2A (0.39) KMT2AL3MBTL1SCDMAPT

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-0911336-B1 PYRIDONECARBOXYLIC ACID DERIVATIVES AND INTERMEDIATES FOR THE SYNTHESIS THEREOF DAINIPPON PHARMACEUTICAL CO (JP) 2001-11-28 EP disclosed