SCHEMBL8320413

SCHEMBL8320413

CC1Sc2c(OC(=O)O)c(=O)c3cc(F)c(F)cc3n21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
PRKD3 O94806 1/20 0.35
PIM1 P11309 1/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
IRAK1 P51617 1/20 0.35
RPS6KA3 P51812 1/20 0.35
DYRK1A Q13627 1/20 0.35
PIM3 Q86V86 1/20 0.35
CSNK1G3 Q9Y6M4 1/20 0.35
KMT2A Q03164 1/20 0.34
TOP2A P11388 1/20 0.30
TOP2B Q02880 1/20 0.30

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
SCHEMBL15789762 0.83 ALDH1A1 (0.52) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9242205 0.83 ALDH1A1 (0.52) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL8326003 0.82 KMT2A (0.33) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9047833 0.82 PIM1 (0.36) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL3004295 0.82 LMNA (0.56) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL13208152 0.79 LMNA (0.46) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL1699779 0.78 LMNA (0.47) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL8318717 0.75 LMNA (0.40) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL9545795 0.75 KMT2A (0.43) LMNAPRKD3PIM1GSK3AGSK3B
SCHEMBL5259393 0.75 LMNA (0.80) LMNAPRKD3PIM1GSK3AGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705828-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1999-12-01 EP disclosed
EP-0721948-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1997-12-03 EP disclosed
EP-0721948-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-07-17 EP disclosed
EP-0705828-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-04-10 EP disclosed