SCHEMBL8566628

SCHEMBL8566628

CCC[C@H](N)C(=O)N[C@H]1CCN(c2c(F)cn3c(=O)c(C(=O)O)cc(C4CC4)c3c2C)C1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.47
KCNH2 Q12809 8/20 0.43
SCN5A Q14524 1/20 0.40
BTK Q06187 4/20 0.35
TOP1 P11387 1/20 0.34
DYRK3 O43781 1/20 0.33
PIM3 Q86V86 1/20 0.33
SRPK1 Q96SB4 1/20 0.33
CSNK1G1 Q9HCP0 1/20 0.33

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
SCHEMBL27366399 0.90 KCNH2 (0.44) SLC2A1KCNH2SCN5ABTKTOP1
Hydrochloric Acid SCHEMBL7504569 0.90 KCNH2 (0.43) SLC2A1KCNH2SCN5ABTKTOP1
SCHEMBL27350832 0.87 KCNH2 (0.41) SLC2A1KCNH2SCN5ABTKTOP1
Hydrochloric Acid SCHEMBL7507501 0.86 KCNH2 (0.41) SLC2A1KCNH2SCN5ABTKTOP1
SCHEMBL8561869 0.86 DYRK3 (0.44) KCNH2SCN5ABTKTOP1DYRK3
SCHEMBL8562871 0.86 KCNH2 (0.41) SLC2A1KCNH2SCN5ABTK
SCHEMBL8576029 0.85 KCNH2 (0.49) SLC2A1KCNH2SCN5A
SCHEMBL8567918 0.85 KCNH2 (0.49) SLC2A1KCNH2SCN5A
SCHEMBL8576032 0.85 KCNH2 (0.49) SLC2A1KCNH2SCN5A
SCHEMBL14497283 0.85 SCN5A (0.43) KCNH2SCN5ABTKTOP1DYRK3

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-0871628-A1 QUINOLIZINONE TYPE COMPOUNDS Abbott Laboratories (US) 1998-10-21 EP disclosed