SCHEMBL7563841

SCHEMBL7563841

CCOC(=O)CN(C)Cc1c(CC)ccc(N)c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 1/20 0.46
GRIA1 P42261 1/20 0.41
GRIA2 P42262 1/20 0.41
GRIA3 P42263 1/20 0.41
GRIA4 P48058 1/20 0.41
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LTA4H P09960 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
HSD17B10 Q99714 1/20 0.34
PPIB P23284 1/20 0.34
PPIA P62937 1/20 0.34

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
SCHEMBL7566004 0.78 GRIA1 (0.43) ALDH1A1SMN1; SMN2KDM4EMAPTGRIA1
SCHEMBL10556095 0.76 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2KDM4EMAPTMEN1
SCHEMBL7564514 0.74 GRIA1 (0.62) ALDH1A1SMN1; SMN2KDM4EMAPTGRIA1
SCHEMBL27434788 0.73 BCL9 (0.31) ALDH1A1
SCHEMBL7565564 0.73 GRIA1 (0.45) ALDH1A1SMN1; SMN2KDM4EMAPTGRIA1
SCHEMBL3147669 0.73 PPID (0.50) ALDH1A1SMN1; SMN2KDM4EMAPTGRIA1
SCHEMBL13222646 0.72 SMN1; SMN2 (0.50) ALDH1A1SMN1; SMN2KDM4EMAPTGRIA1
SCHEMBL7567175 0.71 GRIA1 (0.52) ALDH1A1SMN1; SMN2KDM4EMAPTGRIA1
SCHEMBL13244223 0.69 MEN1 (0.49) ALDH1A1SMN1; SMN2KDM4EMAPTMEN1
SCHEMBL8337648 0.69 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2KDM4EMAPTLTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1125818-C Amino acid derivatives of substituted quinoxaline 2, 3 -dione derivativesa as glutamate receptor antagonists WARNER LAMBERT CO (US) 2003-10-29 CN disclosed
EP-0832074-B1 AMINO ACID DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 2002-09-04 EP disclosed
CN-1187190-A Amino acid derivatives of substituted quinoxaline 2, 3-dione derivatives as glutamate receptor antagonists WARNER LAMBERT CO (US) 1998-07-08 CN disclosed
US-5614508-A ANTIISCHEMIC AGENTS, ALZHEIMERS, STROKE OR NERVOUS SYSTEM DISORDERS WARNER-LAMBERT COMPANY (US) 1997-03-25 US disclosed
WO-1996040649-A1 AMINO ACID DERIVATIVES OF SUBSTITUTED QUINOXALINE 2,3-DIONE DERIVATIVES AS GLUTAMATE RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1996-12-19 WO disclosed