SCHEMBL404243

SCHEMBL404243

CCc1ccc(Br)cc1C1C(=O)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.40
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
ADRA2A P08913 1/20 0.35
PNMT P11086 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
WDR5 P61964 3/20 0.34
ALDH1A1 P00352 3/20 0.34
TP53 P04637 2/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 1/20 0.34
P2RX7 Q99572 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 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
SCHEMBL418249 0.93 LMNA (0.38) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL516049 0.86 SMN1; SMN2 (0.43) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL419382 0.84 ALDH1A1 (0.40) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL993617 0.82 LMNA (0.34) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL406454 0.81 TSHR (0.41) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL3027915 0.80 TSHR (0.38) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL403031 0.79 LMNA (0.38) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL446693 0.79 LMNA (0.38) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL3036820 0.78 TSHR (0.37) TSHRLMNAHPGDSMN1; SMN2L3MBTL1
SCHEMBL415663 0.78 TSHR (0.37) TSHRLMNAHPGDSMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
EP-2389066-A1 CYCLOPENTADIONE DERIVED HERBICIDES Syngenta Limited (GB) 2011-11-30 EP disclosed
WO-2010102848-A1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LIMITED (GB) 2010-09-16 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 (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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 TSHR 1306/4885LMNA 4657/4885HPGD 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.