SCHEMBL9435683

SCHEMBL9435683

CC1CN(c2c(F)c(F)c3c(=O)c(OC(=O)O)cn(C4CC4)c3c2F)CC(C)N1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.72
KMT2A Q03164 2/20 0.72
KCNH2 Q12809 6/20 0.62
POLB P06746 3/20 0.62
CACNA1F O60840 1/20 0.62
MAPK1 P28482 1/20 0.62
CACNA1D Q01668 1/20 0.62
CACNA1S Q13698 1/20 0.62
CACNA1C Q13936 1/20 0.62
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 4/20 0.42
HPGD P15428 4/20 0.42
HSD17B10 Q99714 3/20 0.42
OPRM1 P35372 2/20 0.42
PRKD3 O94806 1/20 0.42
ALOX15 P16050 1/20 0.42
CLK2 P49760 1/20 0.42
CLK4 Q9HAZ1 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TOP2A P11388 3/20 0.40

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
SCHEMBL10679416 1.00 MEN1 (0.72) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL8190975 0.92 KCNH2 (0.74) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL6561367 0.92 KCNH2 (0.74) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL9435843 0.89 MEN1 (0.57) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL10679936 0.88 MEN1 (0.56) MEN1KMT2AKCNH2POLBCACNA1F
Hydrochloric Acid SCHEMBL10686925 0.88 MEN1 (0.56) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL10679869 0.86 MEN1 (0.53) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL10684290 0.85 MEN1 (0.53) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL9636639 0.85 MEN1 (0.55) MEN1KMT2AKCNH2POLBCACNA1F
SCHEMBL10686013 0.84 MEN1 (0.52) MEN1KMT2AKCNH2POLBCACNA1F

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-0375658-B1 Quinoline derivatives and processes for preparation thereof DAINIPPON PHARMACEUTICAL CO (JP) 1994-08-03 EP claimed
EP-0284935-A1 5-Substituted quinolone- and naphthyridone carboxylic acid derivatives BAYER AG (DE) 1988-10-05 EP claimed
EP-0284935-A1 5-Substituted quinolone- and naphthyridone carboxylic acid derivatives BAYER AG (DE) 1988-10-05 EP disclosed