SCHEMBL1344780

SCHEMBL1344780

O=C(O)c1cn(C2CC2)c2c(F)c(F)c(F)c(F)c2c1=O

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.68
KMT2A Q03164 1/20 0.68
TOP2A P11388 5/20 0.65
TOP2B Q02880 5/20 0.65
CACNA1F O60840 1/20 0.60
POLB P06746 1/20 0.60
MAPK1 P28482 1/20 0.60
CACNA1D Q01668 1/20 0.60
KCNH2 Q12809 1/20 0.60
CACNA1S Q13698 1/20 0.60
CACNA1C Q13936 1/20 0.60
GSK3B P49841 10/20 0.59
STAT3 P40763 1/20 0.58
ALDH1A1 P00352 1/20 0.50
HTT P42858 1/20 0.50

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
SCHEMBL6216504 0.90 MEN1 (0.58) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL1345769 0.89 GSK3B (0.70) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL5868648 0.89 GSK3B (0.60) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL8097562 0.89 MEN1 (0.57) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL12674061 0.89 TOP2A (0.67) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL9088265 0.88 MEN1 (0.56) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL9377798 0.86 MEN1 (0.56) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL8327189 0.86 MEN1 (0.54) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL12665523 0.86 MEN1 (0.62) MEN1KMT2ATOP2ATOP2BCACNA1F
SCHEMBL9378534 0.86 MEN1 (0.59) MEN1KMT2ATOP2ATOP2BCACNA1F

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 123 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-62000469-A None JP disclosed
JP-1019069-A None JP disclosed
JP-63045261-A None JP disclosed
EP-2013182-B1 AMINOQUINOLONES AS GSK-3 INHIBITORS KYORIN SEIYAKU KK (JP) 2013-09-04 EP disclosed
EP-2383271-B1 Aminoquinolones as GSK-3 Inhibitors KYORIN SEIYAKU KK (JP) 2013-07-10 EP disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
US-8063221-B2 Aminoquinolones as GSK-3 inhibitors KYORIN PHARMACEUTICAL CO., LTD. (JP) 2011-11-22 US disclosed
EP-2383271-A1 Aminoquinolones as GSK-3 Inhibitors Kyorin Pharmaceutical Co., Ltd. (JP) 2011-11-02 EP disclosed
EP-2383271-A1 Aminoquinolones as GSK-3 Inhibitors Kyorin Pharmaceutical Co., Ltd. (JP) 2011-11-02 EP disclosed
JP-S6345261-A NOVEL QUINOLONE DERIVATIVE, ESTER AND SALT THEREOF DAINIPPON PHARMACEUT CO LTD 1988-02-26 JP disclosed
EP-0247464-A1 New quinolone compounds and a process for the preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1987-12-02 EP disclosed
CN-87103138-A New quinoline and preparation method thereof 1987-11-04 CN disclosed
EP-0242789-A2 Novel quinoline derivates and processes for preparation thereof Dainippon Pharmaceutical Co., Ltd. (JP) 1987-10-28 EP disclosed
EP-0230053-A2 7-(Substituted)piperazinyl-1-ethyl-6-fluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acids AMERICAN CYANAMID COMPANY (US) 1987-07-29 EP disclosed
EP-0221463-A2 Quinoline derivatives and processes for preparation thereof Dainippon Pharmaceutical Co., Ltd. (JP) 1987-05-13 EP disclosed
CN-86107491-A New quinoline and preparation method thereof 1987-04-29 CN disclosed
US-4657913-A Trifluoro- quinoline -3- carboxylic acids and their use as anti-bacterial agents WARNER-LAMBERT COMPANY (US) 1987-04-14 US disclosed
JP-S62469-A NOVEL QUINOLONE DERIVATIVE AND ESTER AND SALT THEREOF DAINIPPON PHARMACEUT CO LTD 1987-01-06 JP disclosed
EP-0202763-A1 5,6-Difluoronaphthyridines and 5,6,8-trifluoro-quinolines as antibacterial agents WARNER-LAMBERT COMPANY (US) 1986-11-26 EP disclosed