SCHEMBL418249

SCHEMBL418249

CCc1ccc(Br)cc1C1C(=O)CCCC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.38
TSHR P16473 2/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
WDR5 P61964 3/20 0.38
POLB P06746 2/20 0.34
MAPK1 P28482 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
HTR2B P41595 1/20 0.33
ADRA2A P08913 1/20 0.33
PNMT P11086 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 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
SCHEMBL404243 0.93 TSHR (0.40) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL419382 0.81 ALDH1A1 (0.40) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL416028 0.81 POLB (0.34) POLBALDH1A1MAPTCYP1A2CYP2C9
SCHEMBL516049 0.80 SMN1; SMN2 (0.43) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL993617 0.80 LMNA (0.34) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL406454 0.78 TSHR (0.41) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL3027915 0.77 TSHR (0.38) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL403031 0.76 LMNA (0.38) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL446693 0.76 LMNA (0.38) LMNATSHRHPGDSMN1; SMN2L3MBTL1
SCHEMBL415663 0.75 TSHR (0.37) LMNATSHRHPGDSMN1; SMN2L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
EP-2387569-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2011-11-23 EP disclosed
WO-2010081755-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-07-22 WO 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 (2 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-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 LMNA 4151/4885TSHR 1474/4885HPGD 2028/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 LMNA 4657/4885TSHR 1306/4885HPGD 2284/4885

“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.