SCHEMBL9824920

SCHEMBL9824920

CCn1c2cc(N3CCC(N)C3)c(F)cc2c(=O)c2c(=O)[nH]oc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 4/20 0.45
GSK3A P49840 2/20 0.45
PIM3 Q86V86 2/20 0.45
PRKD3 O94806 1/20 0.45
GSK3B P49841 1/20 0.45
IRAK1 P51617 1/20 0.45
RPS6KA3 P51812 1/20 0.45
DYRK1A Q13627 1/20 0.45
CSNK1G3 Q9Y6M4 1/20 0.45
TOP1 P11387 2/20 0.42
PIM2 Q9P1W9 3/20 0.40
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 4/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 3/20 0.36
GAA P10253 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
MAPT P10636 1/20 0.36

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
SCHEMBL9824309 0.85 HSD17B10 (0.42) PIM1GSK3APIM3PRKD3PIM2
SCHEMBL9825057 0.85 PRKD3 (0.48) PIM1GSK3APIM3PRKD3GSK3B
SCHEMBL9824649 0.84 PIM1 (0.45) PIM1GSK3APIM3GSK3BTOP1
SCHEMBL9824932 0.83 DRD3 (0.50) PIM1GSK3APIM3PIM2KDM4E
SCHEMBL9824158 0.83 ALDH1A1 (0.52) PIM1GSK3APIM3PIM2KDM4E
SCHEMBL9824004 0.81 TOP1 (0.43) PIM1GSK3APIM3PRKD3GSK3B
SCHEMBL9824535 0.81 KMT2A (0.45) PIM1GSK3APIM3GSK3BDYRK1A
SCHEMBL9824748 0.81 ALDH1A1 (0.49) PIM1GSK3APIM3GSK3BTOP1
SCHEMBL9824093 0.81 PRKD3 (0.47) PIM1GSK3APIM3PRKD3GSK3B
SCHEMBL10768783 0.80 PIM1 (0.40) PIM1PIM3TOP1PIM2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0227088-B1 ISOXAZOLO-NAPHTHYRIDINE, ISOXAZOLO QUINOLINE, ISOTHIAZOLONAPHTHYRIDINE, AND ISOTHIAZOLOQUINOLINE DERIVATIVES ABBOTT LABORATORIES (US) 1991-08-07 EP disclosed
US-4767762-A Tricyclic quinoline and naphthyride antibacterials ABBOTT LABORATORIES (US) 1988-08-30 US disclosed
EP-0227088-A1 Isoxazolo-naphthyridine, isoxazolo quinoline, isothiazolonaphthyridine, and isothiazoloquinoline derivatives ABBOTT LABORATORIES (US) 1987-07-01 EP disclosed