SCHEMBL29911399

SCHEMBL29911399

Cc1c(F)c(F)c(COC(=O)[C@@H]2[C@H](/C=C(\Cl)C(F)(F)F)C2(C)C)c(Cl)c1F

nearest known ligand 0.88

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.88
MEN1 O00255 1/20 0.88
KMT2A Q03164 1/20 0.88
LMNA P02545 2/20 0.39
ADRA2A P08913 1/20 0.39
CNR1 P21554 1/20 0.39
ATM Q13315 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
TSHR P16473 1/20 0.36
IMPDH2 P12268 1/20 0.32

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
SCHEMBL19478315 1.00 TDP1 (0.88) TDP1MEN1KMT2ALMNAADRA2A
SCHEMBL29843079 0.96 TDP1 (0.83) TDP1MEN1KMT2ALMNAADRA2A
SCHEMBL29843237 0.94 TDP1 (0.91) TDP1MEN1KMT2ALMNAADRA2A
SCHEMBL19688213 0.94 TDP1 (0.91) TDP1MEN1KMT2ALMNAADRA2A
Tefluthrin SCHEMBL2740810 0.93 TDP1 (1.00) TDP1MEN1KMT2ALMNAADRA2A
Tefluthrin SCHEMBL1920781 0.93 TDP1 (1.00) TDP1MEN1KMT2ALMNAADRA2A
Tefluthrin SCHEMBL14427331 0.93 TDP1 (1.00) TDP1MEN1KMT2ALMNAADRA2A
Tefluthrin SCHEMBL1898396 0.93 TDP1 (1.00) TDP1MEN1KMT2ALMNAADRA2A
Tefluthrin SCHEMBL21112033 0.93 TDP1 (1.00) TDP1MEN1KMT2ALMNAADRA2A
Tefluthrin SCHEMBL4622567 0.93 TDP1 (1.00) TDP1MEN1KMT2ALMNAADRA2A

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
CN-109071410-B Ester compound and use thereof 大日本除虫菊株式会社 2022-11-01 CN claimed
CN-109071410-B Ester compound and use thereof 大日本除虫菊株式会社 2022-11-01 CN disclosed