SCHEMBL8137121

SCHEMBL8137121

C[C@H](CN1C(=O)c2ccc3c(c2C1=O)c1cc([N+](=O)[O-])ccc1n3C)NCCN[C@H](C)CN1C(=O)c2ccc3c(c2C1=O)c1cc([N+](=O)[O-])ccc1n3C

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
F2RL3 Q96RI0 6/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
LMNA P02545 1/20 0.38
F2R P25116 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ALOX5 P09917 1/20 0.36
WEE1 P30291 1/20 0.36
ACHE P22303 1/20 0.35
ALDH1A1 P00352 1/20 0.35
FTO Q9C0B1 1/20 0.35

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
SCHEMBL7971323 0.95 MAPT (0.39) MAPTF2RL3MEN1KMT2ALMNA
SCHEMBL8559970 0.80 MAPT (0.37) MAPTF2RL3MEN1KMT2ALMNA
SCHEMBL7985009 0.71 MAPT (0.56) MAPTF2RL3MEN1KMT2ALMNA
SCHEMBL8156893 0.69 KDM4E (0.41) MAPTMEN1KMT2AALDH1A1FTO
SCHEMBL9134908 0.69 FTO (0.67) MAPTMEN1KMT2ALMNAL3MBTL1
SCHEMBL9134914 0.69 FTO (0.67) MAPTMEN1KMT2ALMNAL3MBTL1
SCHEMBL9136054 0.69 FTO (0.67) MAPTMEN1KMT2ALMNAL3MBTL1
SCHEMBL9137315 0.69 FTO (0.67) MAPTMEN1KMT2ALMNAL3MBTL1
SCHEMBL7988881 0.68 FTO (0.47) MAPTMEN1KMT2AL3MBTL1ALDH1A1
SCHEMBL9048939 0.67 FTO (0.44) MAPTMEN1KMT2ALMNASMN1; SMN2

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
EP-0820985-B1 Bis imide derivatives, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2000-08-30 EP disclosed
EP-0820985-A1 Bis imide derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-01-28 EP disclosed