SCHEMBL10195099

SCHEMBL10195099

CCc1ccc(Oc2ccc(C#N)cc2F)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.33
KCNH2 Q12809 2/20 0.33
SLC6A4 P31645 1/20 0.33
TBXA2R P21731 4/20 0.32
NR3C1 P04150 1/20 0.32
PGR P06401 1/20 0.32
NR3C2 P08235 1/20 0.32
EGLN2 Q96KS0 3/20 0.32
EGLN1 Q9GZT9 3/20 0.32
MAPK14 Q16539 1/20 0.32
GPR119 Q8TDV5 1/20 0.32
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
AR P10275 3/20 0.31
BRD4 O60885 1/20 0.31
STK10 O94804 1/20 0.30
SLK Q9H2G2 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
SCHEMBL10195176 0.89 FFAR1 (0.40) HTR2AKCNH2SLC6A4TBXA2RNR3C1
SCHEMBL10195289 0.89 EGLN2 (0.33) PGREGLN2EGLN1
SCHEMBL10195177 0.88 AR (0.39) AR
SCHEMBL10195084 0.88 MAPK14 (0.42) HTR2AKCNH2SLC6A4MAPK14AR
SCHEMBL10195183 0.87 PGR (0.37) PGR
SCHEMBL416035 0.87 TBXA2R (0.32) HTR2AKCNH2SLC6A4TBXA2RNR3C1
SCHEMBL16181150 0.87 PPARG (0.34) MAPK14BRD4
SCHEMBL10195667 0.86 TBXA2R (0.31) HTR2AKCNH2SLC6A4TBXA2RGPR119
SCHEMBL10195083 0.86 SLC6A4 (0.38) HTR2AKCNH2SLC6A4MAPK14BRD4
SCHEMBL10195073 0.86 MAPK14 (0.33) MAPK14

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 HTR2A 1192/4885KCNH2 1267/4885SLC6A4 1501/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 HTR2A 1320/4885KCNH2 1805/4885SLC6A4 1443/4885

“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.