SCHEMBL7760451

SCHEMBL7760451

CC(=NO)C(=NN)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.48
CYP2C19 P33261 1/20 0.48
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 1/20 0.36
HPGD P15428 1/20 0.36
GFER P55789 1/20 0.36
NOS3 P29474 2/20 0.35
NOS1 P29475 2/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
LMNA P02545 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
ATM Q13315 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
GLA P06280 1/20 0.35
MAPT P10636 1/20 0.35

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
SCHEMBL7760450 1.00 GAA (0.48) GAACYP2C19ALDH1A1HSD17B10HPGD
SCHEMBL5265634 0.85 GAA (0.54) GAACYP2C19ALDH1A1HSD17B10HPGD
SCHEMBL5265637 0.85 GAA (0.54) GAACYP2C19ALDH1A1HSD17B10HPGD
SCHEMBL29084213 0.80 GAA (0.59) GAACYP2C19ALDH1A1HSD17B10HPGD
SCHEMBL18797319 0.79 CYP2C19 (0.50) GAACYP2C19ALDH1A1HSD17B10CES2
SCHEMBL20721103 0.79 CYP2C19 (0.50) GAACYP2C19ALDH1A1HSD17B10CES2
SCHEMBL7757269 0.78 GAA (0.42) GAACYP2C19ALDH1A1HSD17B10HPGD
SCHEMBL8532484 0.77 CES2 (0.52) GAACYP2C19ALDH1A1HSD17B10CES2
SCHEMBL8460844 0.76 GAA (0.41) GAACYP2C19ALDH1A1HSD17B10HPGD
SCHEMBL5597826 0.76 GAA (0.41) GAACYP2C19ALDH1A1HSD17B10HPGD

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
EP-0873305-B1 AZINOOXIMETHERS, PROCESSES AND INTERMEDIATE PRODUCTS FOR MANUFACTURING SAME, AND THE USES THEREOF IN COMBATING HARMFUL FUNGI AND PESTS BASF AG (DE) 2001-03-28 EP disclosed
US-6043282-A FUNGICIDES, PESTICIDES, INSECTICIDES, NEMATOCIDES, MITICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-03-28 US disclosed