SCHEMBL10195083

SCHEMBL10195083

CCc1ccc(Oc2ccc(Cl)cc2F)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.38
KCNH2 Q12809 7/20 0.38
HTR2A P28223 6/20 0.38
HIF1A Q16665 1/20 0.37
SLC6A2 P23975 2/20 0.34
SLC6A3 Q01959 1/20 0.34
SCN8A Q9UQD0 1/20 0.34
SCN10A Q9Y5Y9 1/20 0.34
SCN9A Q15858 5/20 0.34
BRD4 O60885 1/20 0.34
MAPK14 Q16539 1/20 0.33
SOS1 Q07889 1/20 0.32

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
SCHEMBL10192899 0.93 SLC6A4 (0.38) SLC6A4KCNH2HTR2AHIF1ASLC6A2
SCHEMBL10195097 0.90 HTR2A (0.39) SLC6A4KCNH2HTR2AHIF1ASLC6A2
SCHEMBL10195084 0.90 MAPK14 (0.42) SLC6A4KCNH2HTR2AHIF1AMAPK14
SCHEMBL10195307 0.89 SLC6A4 (0.36) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL16181150 0.89 PPARG (0.34) BRD4MAPK14
SCHEMBL10195308 0.88 SLC6A4 (0.38) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL10195073 0.88 MAPK14 (0.33) MAPK14
SCHEMBL10195103 0.88 SLC6A4 (0.36) SLC6A4KCNH2HTR2ASLC6A2SLC6A3
SCHEMBL10195082 0.87 ALDH1A1 (0.36) SLC6A4HTR2AHIF1A
SCHEMBL10195104 0.87 HTR2A (0.38) SLC6A4KCNH2HTR2AHIF1ASOS1

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 8 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-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-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
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US 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 SLC6A4 1501/4885KCNH2 1267/4885HTR2A 1192/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 SLC6A4 1443/4885KCNH2 1805/4885HTR2A 1320/4885

“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.