SCHEMBL5569807

SCHEMBL5569807

CCC(C)Oc1ccccc1OC(=O)NC

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.71
ACHE P22303 1/20 0.71
PGR P06401 1/20 0.50
GAA P10253 1/20 0.50
PTGS1 P23219 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
MTNR1A P48039 1/20 0.46
MTNR1B P49286 1/20 0.46
CYP1A2 P05177 1/20 0.42
KDM4E B2RXH2 3/20 0.40
KMT2A Q03164 3/20 0.40
LMNA P02545 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
MCHR1 Q99705 1/20 0.38
CHRM2 P08172 1/20 0.38
CHRM4 P08173 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38

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
SCHEMBL11852286 0.85 ALDH1A1 (0.64) ALDH1A1ACHEPGRGAAPTGS1
SCHEMBL11509640 0.85 ALDH1A1 (0.68) ALDH1A1ACHEPGRGAAPTGS1
SCHEMBL11848573 0.85 ALDH1A1 (0.68) ALDH1A1ACHEPGRGAAPTGS1
SCHEMBL11855036 0.84 ALDH1A1 (0.62) ALDH1A1ACHEPGRGAAPTGS1
Propoxur SCHEMBL6357408 0.83 ALDH1A1 (1.00) ALDH1A1ACHEPGRGAAPTGS1
Propoxur SCHEMBL27794 0.83 ALDH1A1 (1.00) ALDH1A1ACHEPGRGAAPTGS1
Propoxur SCHEMBL11572270 0.82 ALDH1A1 (0.97) ALDH1A1ACHEPGRGAAPTGS1
SCHEMBL6023331 0.82 ALDH1A1 (0.49) ALDH1A1ACHEPGRGAAPTGS1
SCHEMBL6024232 0.81 ALDH1A1 (0.48) ALDH1A1ACHEPGRGAAPTGS1
Fenobucarb SCHEMBL6446466 0.80 ALDH1A1 (0.47) ALDH1A1ACHEPGRGAAPTGS1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8834909-B2 Granule baits NOVARTIS AG (CH) 2014-09-16 US disclosed
US-20070071784-A1 Organic compounds ELANCO TIERGESUNDHEIT AG (CH) 2007-03-29 US disclosed
US-4205066-A Bait compositions for anthropophilic flies AIRWICK INDUSTRIES, INC. (US) 1980-05-27 US disclosed
US-4067990-A SOLUTION OF A PHENYL N-METHYL CARBAMATE AIRWICK INDUSTRIES, INC. (US) 1978-01-10 US disclosed