SCHEMBL14437286

SCHEMBL14437286

CCOc1ccnc2ccc(/C=C3\SC(NCc4ccc(F)cc4Cl)=NC3=O)cc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CISD1 Q9NZ45 1/20 0.45
MEN1 O00255 6/20 0.39
KMT2A Q03164 6/20 0.39
GAA P10253 1/20 0.39
ALOX5 P09917 2/20 0.37
SLC2A1 P11166 1/20 0.35
BRD4 O60885 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
HPGD P15428 1/20 0.33
PIM1 P11309 2/20 0.33
CLK2 P49760 2/20 0.33
DYRK1A Q13627 2/20 0.33
ARNT P27540 1/20 0.33
EPAS1 Q99814 1/20 0.33
PIK3CD O00329 1/20 0.33
GAK O14976 1/20 0.33

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
SCHEMBL14437272 0.89 CISD1 (0.41) CISD1MEN1KMT2AGAAALOX5
SCHEMBL5508740 0.87 CISD1 (0.36) CISD1MEN1KMT2AGAASLC2A1
SCHEMBL3868501 0.83 CISD1 (0.41) CISD1MEN1KMT2AGAAALOX5
SCHEMBL13897380 0.83 CISD1 (0.41) CISD1MEN1KMT2AGAAALOX5
SCHEMBL3868504 0.83 CISD1 (0.41) CISD1MEN1KMT2AGAAALOX5
SCHEMBL14437276 0.82 CISD1 (0.40) CISD1MEN1KMT2AGAAALOX5
SCHEMBL5505342 0.81 CISD1 (0.48) CISD1MEN1KMT2AGAAALOX5
SCHEMBL14437310 0.81 CISD1 (0.48) CISD1MEN1KMT2AGAAALOX5
SCHEMBL5505339 0.81 CISD1 (0.48) CISD1MEN1KMT2AGAAALOX5
SCHEMBL14437200 0.80 MEN1 (0.41) CISD1MEN1KMT2AGAAALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7253285-B2 Thiazolinone 4-monosubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed
US-7253285-B2 Thiazolinone 4-monosubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2007-08-07 US disclosed