SCHEMBL9607468

SCHEMBL9607468

Cc1c(-c2cccc(Cc3ccc(OC(F)(F)F)cc3)c2)[nH]c2ccc(Cl)cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAT2A P31153 1/20 0.44
PDE10A Q9Y233 1/20 0.41
CYP2C9 P11712 1/20 0.40
PTGS2 P35354 2/20 0.40
CNR1 P21554 2/20 0.39
SNCA P37840 1/20 0.39
DDR1 Q08345 1/20 0.39

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
SCHEMBL8531036 0.93 CYP2C9 (0.44) MAT2APDE10ACYP2C9PTGS2DDR1
SCHEMBL8532926 0.93 MAT2A (0.51) MAT2A
SCHEMBL8537794 0.89 MAT2A (0.50) MAT2ACYP2C9
SCHEMBL9607503 0.86 MAT2A (0.47) MAT2ACYP2C9
SCHEMBL8535303 0.83 MAT2A (0.55) MAT2ACNR1
SCHEMBL9607504 0.82 MAT2A (0.46) MAT2ACYP2C9
SCHEMBL20983234 0.80 MAT2A (0.58) MAT2A
SCHEMBL8536502 0.80 MAT2A (0.43) MAT2ACNR1DDR1
SCHEMBL8532964 0.80 MAT2A (0.52) MAT2APDE10A
SCHEMBL8538786 0.78 MAT2A (0.45) MAT2ACNR1

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
WO-2012069856-A1 ANTIMALARIAL COMPOUNDS LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) 2012-05-31 WO disclosed