SCHEMBL7673239

SCHEMBL7673239

CN(C)NC(=O)NCc1cccc(-c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 3/20 0.58
PADI3 Q9ULW8 2/20 0.52
PADI1 Q9ULC6 1/20 0.52
ERAP2 Q6P179 1/20 0.51
ERAP1 Q9NZ08 1/20 0.51
LNPEP Q9UIQ6 1/20 0.51
LIPG Q9Y5X9 1/20 0.49
KCNB1 Q14721 1/20 0.48
PSMB1 P20618 1/20 0.48
PSMB5 P28074 1/20 0.48
PSMB2 P49721 1/20 0.48
ATG4B Q9Y4P1 1/20 0.47
CFD P00746 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
SRC P12931 1/20 0.46
PTGES O14684 1/20 0.46
ADAMTS5 Q9UNA0 1/20 0.46
EPHX2 P34913 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
SCHEMBL10583653 0.86 SMN1; SMN2 (0.61) CFDSMN1; SMN2EPHX2
SCHEMBL14365887 0.83 AOC3 (0.63) AOC3PADI3PADI1ERAP2ERAP1
SCHEMBL6418674 0.80 AOC3 (0.67) AOC3PADI3PADI1ERAP2ERAP1
SCHEMBL7664680 0.79 NPC1 (0.51) SMN1; SMN2
SCHEMBL6230841 0.77 AOC3 (0.63) AOC3PADI3PADI1ERAP2ERAP1
SCHEMBL30259900 0.77 AOC3 (0.72) AOC3PADI3PADI1ERAP2ERAP1
SCHEMBL18638228 0.76 ERAP2 (0.67) AOC3ERAP2ERAP1LNPEPLIPG
SCHEMBL5726547 0.75 CFD (0.71) AOC3CFDSMN1; SMN2EPHX2NR1H4
SCHEMBL7667380 0.74 CA2 (0.43) SMN1; SMN2
SCHEMBL7662618 0.74 PPARG (0.53) SMN1; SMN2

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-6489487-B1 AGRICULTURAL OR HORTICULTURAL FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-12-03 US disclosed
EP-1103548-A1 TRIAZOLONE DERIVATIVES, USE THEREOF, AND INTERMEDIATE THEREFOR SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2001-05-30 EP disclosed