SCHEMBL4765059

SCHEMBL4765059

CC(CCCCOC(=O)c1ccc2ncn(CCCCC(C)=C(F)F)c2c1)=C(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.43
HTT P42858 6/20 0.43
LMNA P02545 5/20 0.42
MAPT P10636 5/20 0.42
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HPGD P15428 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
GAA P10253 1/20 0.41
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
STAT3 P40763 1/20 0.40
MTNR1A P48039 1/20 0.40
MTNR1B P49286 1/20 0.40
TP53 P04637 1/20 0.39
PLA2G4A P47712 1/20 0.37
EGLN3 Q9H6Z9 1/20 0.37
NPC1 O15118 1/20 0.36

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
SCHEMBL4763858 0.92 HPGD (0.44) SMN1; SMN2HTTLMNAMAPTKDM4E
SCHEMBL4763346 0.80 HDAC1 (0.38) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL4767258 0.76 MAPT (0.45) SMN1; SMN2MAPTKDM4EALDH1A1MEN1
SCHEMBL25998805 0.76 SIRT2 (0.49) SMN1; SMN2HTTLMNAMAPTKDM4E
SCHEMBL11351335 0.75 ESR1 (0.52) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL9039147 0.74 NPC1 (0.50) SMN1; SMN2LMNAALDH1A1MEN1KMT2A
SCHEMBL4763706 0.74 TUBB4A (0.42) RAB9AHDAC6
SCHEMBL4764986 0.73 CTNNB1 (0.46) ALDH1A1MEN1KMT2AGAAHDAC6
SCHEMBL25999218 0.73 SMN1; SMN2 (0.45) SMN1; SMN2HTTLMNAMAPTKDM4E
SCHEMBL29738011 0.72 MEN1 (0.54) SMN1; SMN2HTTMEN1KMT2AALOX15

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1439169-B1 DIFLUOROALKENE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE SAME, AND INTERMEDIATE THEREFOR KUMIAI CHEMICAL INDUSTRY CO (JP) 2008-08-06 EP disclosed
US-7273878-B2 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2007-09-25 US disclosed
US-20040248872-A1 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2004-12-09 US disclosed
EP-1439169-A1 DIFLUOROALKENE DERIVATIVE, PEST CONTROL AGENT CONTAINING THE SAME, AND INTERMEDIATE THEREFOR KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2004-07-21 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040248872-A1 Difluoroalkene derivative, pest control agent containing the same, and intermediate therefor DDT, WEE1, NOTUM SMN1; SMN2 2115/4885HTT 4141/4885LMNA 4259/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.