SCHEMBL31065271

SCHEMBL31065271

CC(C)OC(=O)C1=CC=CON1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 6/20 0.37
CA1 P00915 6/20 0.37
CA2 P00918 6/20 0.37
CA7 P43166 6/20 0.37
CA9 Q16790 6/20 0.37
CA14 Q9ULX7 6/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP9 P14780 1/20 0.36
MMP12 P39900 1/20 0.36
KDM4E B2RXH2 5/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 2/20 0.35
HSD17B10 Q99714 2/20 0.35
USP2 O75604 1/20 0.35
PDCD1 Q15116 1/20 0.34
CD274 Q9NZQ7 1/20 0.34
TP53 P04637 1/20 0.33

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
SCHEMBL31305620 0.74 ELANE (0.32)
SCHEMBL3229471 0.71
SCHEMBL16095021 0.70
Potassium SCHEMBL31003003 0.70
Potassium Ion SCHEMBL31448342 0.68
SCHEMBL31002999 0.68
SCHEMBL3259932 0.66
Hydrochloric Acid SCHEMBL31533309 0.66
SCHEMBL10261177 0.63 CA12 (0.41) CA12CA1CA2CA7CA9
SCHEMBL9788721 0.61 CA12 (0.50) CA12CA1CA2CA7CA9

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
CN-118661736-A Insecticidal composition containing pyriproxyfen and isoxazole insect amide and application thereof 广西思钺生物科技有限责任公司 2024-09-20 CN disclosed