SCHEMBL8994470

SCHEMBL8994470

CC(C)=CC1C(C(=O)OCn2c(-c3ccc(Cl)cc3)c(C#N)c(Cl)c2C(F)(F)F)C1(C)C

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
CYP1A2 P05177 3/20 0.37
CYP2C19 P33261 3/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
TDP1 Q9NUW8 3/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 3/20 0.32
RXFP1 Q9HBX9 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ADRA2A P08913 1/20 0.30
CNR1 P21554 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL8994390 0.80 L3MBTL1 (0.35) LMNAMEN1KMT2ATSHRRXFP1
Tetramethrin SCHEMBL7173440 0.79 LMNA (0.35) LMNACYP1A2CYP2C19CYP3A4CYP2D6
SCHEMBL8994386 0.78 PAX8 (0.35) LMNATDP1MEN1KMT2ATSHR
Chlorfenapyr SCHEMBL7173540 0.78 LMNA (0.56) LMNA
SCHEMBL9017316 0.77 RXFP1 (0.37) LMNACYP1A2CYP2C19CYP3A4CYP2C9
Phenothrin SCHEMBL7178043 0.76 TDP1 (0.54) LMNACYP1A2CYP2C19CYP3A4CYP2D6
Bioresmethrin SCHEMBL7173159 0.75 TDP1 (0.38) LMNACYP1A2CYP2C19CYP3A4CYP2D6
Resmethrin SCHEMBL7174459 0.75 TDP1 (0.38) LMNACYP1A2CYP2C19CYP3A4CYP2D6
Chlorfenapyr SCHEMBL7170476 0.75
SCHEMBL5815133 0.74 KDM4E (0.36) LMNAMEN1KMT2ARXFP1KDM4E

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-0594941-B1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID CO (US) 1996-08-14 EP claimed
EP-0594941-A1 N-substituted carbonyoxyalkylpyrrole insecticidal, acaricidal and molluscicidal agents AMERICAN CYANAMID COMPANY (US) 1994-05-04 EP claimed