SCHEMBL10550257

SCHEMBL10550257

O=C(O)c1cc(F)c(O)nc1Nc1ccc(F)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.55
CSNK2A1 P68400 2/20 0.48
CSNK2A2 P19784 1/20 0.48
CSNK2B P67870 1/20 0.48
XDH P47989 1/20 0.46
SLC22A12 Q96S37 1/20 0.46
GSK3B P49841 2/20 0.45
CDC7 O00311 1/20 0.45
DAPK3 O43293 1/20 0.45
PAK4 O96013 1/20 0.45
PIM1 P11309 1/20 0.45
CDK2 P24941 1/20 0.45
FLT3 P36888 1/20 0.45
CDK9 P50750 1/20 0.45
CDK5 Q00535 1/20 0.45
DYRK1A Q13627 1/20 0.45
MELK Q14680 1/20 0.45
MINK1 Q8N4C8 1/20 0.45
HIPK2 Q9H2X6 1/20 0.45
STK17A Q9UEE5 1/20 0.45

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
SCHEMBL894633 0.85 KEAP1 (0.55) DHODHCSNK2A1CSNK2A2CSNK2BXDH
SCHEMBL10550275 0.84 L3MBTL1 (0.44) DHODHCSNK2A1CSNK2A2CSNK2BCDK2
SCHEMBL10757185 0.82 CSNK2A1 (0.47) DHODHCSNK2A1MEN1KMT2AMAPT
SCHEMBL10547323 0.77 LMNA (0.44) MEN1KMT2AMAPTALDH1A1CYP1A2
SCHEMBL15638933 0.77 DHODH (0.64) DHODHCSNK2A1CSNK2A2CSNK2BXDH
SCHEMBL24279936 0.77 KEAP1 (0.55) DHODHCSNK2A1CSNK2A2CSNK2BXDH
SCHEMBL10469514 0.76 KEAP1 (0.44) DHODHMAPK8AURKAMAPTALDH1A1
SCHEMBL6801722 0.74 CTSV (0.60) DHODHXDHSLC22A12GSK3BCDC7
SCHEMBL10169403 0.72 SYK (0.44) DHODHMAPTALDH1A1TP53
SCHEMBL894667 0.72 MAPK9 (0.47) DHODHCSNK2A1CSNK2A2CSNK2BFLT3

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-4851535-A 2-(5-FLUORONICOTINOYL)ACETIC ACID DERIVATIVES, ANTIBACTERIAL 1-ARYL-1,4-DIHYDRO-4-OXONAPHTHYRIDINES TOYAMA CHEMICAL CO., LTD. (JP) 1989-07-25 US disclosed
US-4704459-A VILSMEIER REAGENT TOYAMA CHEMICAL CO., LTD. (JP) 1987-11-03 US disclosed