SCHEMBL8900898

SCHEMBL8900898

FC(F)(F)c1ccc(C(F)(F)F)c(Oc2cc(Cl)c(OCC=C(Br)Br)cc2Cl)n1

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.32
HPGD P15428 2/20 0.32
HTT P42858 2/20 0.32
GAA P10253 1/20 0.32
ATM Q13315 1/20 0.32
MBOAT4 Q96T53 1/20 0.32
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TSHR P16473 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
ALDH1A1 P00352 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
SCHEMBL8636562 0.90 HPGD (0.33) L3MBTL1HPGDHTTGAAATM
SCHEMBL8636420 0.80 SCN9A (0.35) L3MBTL1HPGDLMNACYP1A2CYP2C19
SCHEMBL8632225 0.79 CYP1A2 (0.40) HPGDLMNACYP1A2CYP2C19ALDH1A1
SCHEMBL8635428 0.76 RXRA (0.39)
SCHEMBL8636541 0.76 CYP1A2 (0.50) HPGDKDM4ELMNACYP1A2CYP2C19
SCHEMBL8634874 0.75 CYP1A2 (0.41) L3MBTL1HPGDLMNACYP1A2CYP2C19
SCHEMBL8634035 0.72 MRGPRX4 (0.34) ALDH1A1
SCHEMBL8637913 0.70 CYP1A2 (0.46) HPGDKDM4ELMNACYP1A2CYP2C19
SCHEMBL8633759 0.69 PNLIP (0.38) HPGDHTTKDM4ECYP1A2CYP2C19
SCHEMBL8631850 0.69 SCN9A (0.34) L3MBTL1HPGDLMNACYP1A2CYP2C19

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
US-5698702-A INTERMEDIATES FOR INSECTICIDES, ACARICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-12-16 US disclosed
US-5530015-A Dihaloprene compound, insecticide/acaricide containing said dihalopropene compound as active ingredient, and intermediate compound for use in production of said dihalopropene compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-06-25 US disclosed