SCHEMBL10665222

SCHEMBL10665222

O=C(O)c1c(Cl)n(-c2ccc(F)cc2)c2ccc(F)cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP14 P54578 1/20 0.42
RORC P51449 2/20 0.41
JAK2 O60674 1/20 0.40
JAK3 P52333 1/20 0.40
NOTUM Q6P988 1/20 0.40
KCNH2 Q12809 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.36
GFER P55789 1/20 0.36
DHODH Q02127 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
KDM4E B2RXH2 1/20 0.36
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 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
SCHEMBL27289772 0.84 GLA (0.38) USP14RORCJAK2JAK3DHODH
SCHEMBL9443584 0.77 KDM4E (0.50) USP14KDM4E
SCHEMBL6052822 0.76 PER2 (0.37) RORCL3MBTL1GAADHODHKDM4E
SCHEMBL9443480 0.76 USP14 (0.48) USP14KDM4E
SCHEMBL1150397 0.75 USP14 (0.43) USP14NOTUMDHODHTDP1
SCHEMBL21666720 0.73 JAK2 (0.47) JAK2JAK3GAAKDM4E
SCHEMBL27286483 0.72 KDM4E (0.45) USP14L3MBTL1KDM4E
SCHEMBL27926513 0.72 EDNRA (0.47) L3MBTL1GAAGFERKDM4E
SCHEMBL9443555 0.72 KDM4E (0.46) USP14JAK2JAK3GAAGFER
SCHEMBL1144756 0.72 KDM4E (0.47) USP14NOTUMGAAGFERKDM4E

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
US-4730000-A 7-SUBSTITUTED AMINO-6-FLUORO-1,4-DIHYDRO-4-OXOQUINOLINE-3-CARBOXYLIC ACIDS AND ESTERS ABBOTT LABORATORIES (US) 1988-03-08 US disclosed