SCHEMBL8775748

SCHEMBL8775748

CC(c1cccc(OC(c2ccccc2)c2cccnc2)c1)N(O)C(N)=O

nearest known ligand 0.63

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.63
TRPM8 Q7Z2W7 4/20 0.45
HTT P42858 2/20 0.40
KCNA5 P22460 1/20 0.39
ALDH1A1 P00352 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
SCHEMBL8775912 0.79 CA12 (0.41) ALOX5TRPM8HTT
SCHEMBL8775901 0.79 ALDH1A1 (0.47) HTTALDH1A1
SCHEMBL8776036 0.78 ALOX5 (0.52) ALOX5TRPM8HTTKCNA5
SCHEMBL8775896 0.77 ALDH1A1 (0.54) ALDH1A1
SCHEMBL8775797 0.74 MMP1 (0.45) ALOX5HTTKCNA5ALDH1A1
SCHEMBL8775835 0.72 MAOA (0.43) HTTKCNA5ALDH1A1
SCHEMBL8775947 0.72 MAPK1 (0.47) HTT
SCHEMBL13524545 0.72 ALOX5 (1.00) ALOX5
SCHEMBL27687109 0.70 SMN1; SMN2 (0.50) HTTKCNA5ALDH1A1
SCHEMBL9476354 0.69 ALOX5 (0.64) ALOX5ALDH1A1

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
EP-0807626-A1 N-HYDROXYUREA DERIVATIVES Nikken Chemicals Company, Limited (JP) 1997-11-19 EP disclosed