SCHEMBL11207617

SCHEMBL11207617

CNC(=O)Oc1ccccc1-c1ccccc1OC(C)C

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.79
ACHE P22303 2/20 0.79
GAA P10253 2/20 0.51
HSD17B10 Q99714 2/20 0.51
PGR P06401 1/20 0.51
PTGS1 P23219 1/20 0.51
MAPK1 P28482 1/20 0.51
IRAK4 Q9NWZ3 2/20 0.46
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
SLC9A1 P19634 1/20 0.42
KMT2A Q03164 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
BCHE P06276 1/20 0.40
MEN1 O00255 1/20 0.40

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
Propoxur SCHEMBL6357408 0.88 ALDH1A1 (1.00) ALDH1A1ACHEGAAHSD17B10PGR
Propoxur SCHEMBL27794 0.88 ALDH1A1 (1.00) ALDH1A1ACHEGAAHSD17B10PGR
Propoxur SCHEMBL11572270 0.87 ALDH1A1 (0.97) ALDH1A1ACHEGAAHSD17B10PGR
Propoxur SCHEMBL7526864 0.84 ALDH1A1 (0.90) ALDH1A1ACHEGAAHSD17B10PGR
Propoxur SCHEMBL7591934 0.83 ALDH1A1 (0.88) ALDH1A1ACHEGAAHSD17B10PGR
Propoxur SCHEMBL5933803 0.81 ALDH1A1 (0.85) ALDH1A1ACHEGAAHSD17B10PGR
SCHEMBL31634047 0.78 IRAK4 (0.50) ALDH1A1ACHEHSD17B10IRAK4SLC9A1
SCHEMBL3632568 0.78 IRAK4 (0.50) ALDH1A1ACHEHSD17B10IRAK4SLC9A1
Propoxur SCHEMBL9371261 0.75 ALDH1A1 (0.72) ALDH1A1ACHEGAAHSD17B10PGR
Isoprocarb SCHEMBL6739739 0.75 ALDH1A1 (0.65) ALDH1A1ACHEGAAHSD17B10PGR

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
US-4369176-A Method of attracting and killing insects FARNAM LIVESTOCK EQUIPMENT AND INSECTICIDES, INC. (US) 1983-01-18 US disclosed