SCHEMBL8561869

SCHEMBL8561869

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

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DYRK3 O43781 1/20 0.44
PIM3 Q86V86 1/20 0.44
SRPK1 Q96SB4 1/20 0.44
CSNK1G1 Q9HCP0 1/20 0.44
SMPD3 Q9NY59 5/20 0.42
SCN5A Q14524 1/20 0.41
KCNH2 Q12809 4/20 0.39
BTK Q06187 2/20 0.36
CREBBP Q92793 2/20 0.36
TOP1 P11387 1/20 0.34
AKT1 P31749 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
SCHEMBL8569098 0.91 KCNH2 (0.42) DYRK3PIM3SRPK1CSNK1G1SCN5A
SCHEMBL8569090 0.91 KCNH2 (0.42) DYRK3PIM3SRPK1CSNK1G1SCN5A
SCHEMBL8564024 0.90 SCN5A (0.42) DYRK3PIM3SRPK1CSNK1G1SCN5A
SCHEMBL14497283 0.90 SCN5A (0.43) DYRK3PIM3SRPK1CSNK1G1SCN5A
Hydrochloric Acid SCHEMBL7502027 0.90 KCNH2 (0.42) DYRK3PIM3SRPK1CSNK1G1SCN5A
Hydrochloric Acid SCHEMBL7502024 0.90 KCNH2 (0.42) DYRK3PIM3SRPK1CSNK1G1SCN5A
Hydrochloric Acid SCHEMBL8576586 0.89 SCN5A (0.41) DYRK3PIM3SRPK1CSNK1G1SCN5A
SCHEMBL27366399 0.89 KCNH2 (0.44) DYRK3PIM3SRPK1CSNK1G1SMPD3
Hydrochloric Acid SCHEMBL7504569 0.88 KCNH2 (0.43) DYRK3PIM3SRPK1CSNK1G1SMPD3
SCHEMBL7501829 0.88 SCN5A (0.38) DYRK3PIM3SRPK1CSNK1G1SCN5A

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
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 WO claimed
EP-0871628-A1 QUINOLIZINONE TYPE COMPOUNDS Abbott Laboratories (US) 1998-10-21 EP disclosed
US-5726182-A TREATMENT OF BACTERIAL INFECTIONS ABBOTT LABORATORIES (US) 1998-03-10 US disclosed
US-5599816-A BACTERICIDE ABBOTT LABORATORIES (US) 1997-02-04 US disclosed
WO-1996039407-A1 QUINOLIZINONE TYPE COMPOUNDS ABBOTT LABORATORIES (US) 1996-12-12 WO disclosed