SCHEMBL8514142

SCHEMBL8514142

CCOC(=O)c1c(-c2ccc(Cc3ccc(OC(F)(F)F)cc3)cc2)[nH]c2cc(Cl)ccc2c1=O

nearest known ligand 0.53

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.48
ALOX15 P16050 10/20 0.47
PTGES O14684 2/20 0.44
OPRK1 P41145 1/20 0.42

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
SCHEMBL8512624 0.93 ALOX5 (0.50) ALOX5ALOX15PTGES
SCHEMBL8512623 0.88 NPC1 (0.47) ALOX5PTGES
SCHEMBL8535303 0.86 MAT2A (0.55)
SCHEMBL8532144 0.83 TUBB4A (0.40)
SCHEMBL8512448 0.81 KMT2A (0.50) ALOX5PTGES
SCHEMBL8532926 0.79 MAT2A (0.51)
SCHEMBL8538786 0.77 MAT2A (0.45) ALOX15PTGES
SCHEMBL8537070 0.77 MAT2A (0.57)
SCHEMBL20983232 0.77 MAT2A (0.55) ALOX5
SCHEMBL8533461 0.75 MAT2A (0.56)

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