SCHEMBL10195176

SCHEMBL10195176

CCc1ccc(Oc2ccc(C#N)cc2Cl)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.40
KCNH2 Q12809 4/20 0.39
HTR2A P28223 3/20 0.39
SLC6A4 P31645 3/20 0.39
AR P10275 2/20 0.36
SLC6A3 Q01959 1/20 0.36
MRGPRX4 Q96LA9 2/20 0.34
ESRRA P11474 1/20 0.34
EGLN2 Q96KS0 4/20 0.33
EGLN1 Q9GZT9 4/20 0.33
TBXA2R P21731 2/20 0.32
NR3C1 P04150 1/20 0.31
PGR P06401 1/20 0.31
NR3C2 P08235 1/20 0.31

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
SCHEMBL10195099 0.89 HTR2A (0.33) FFAR1KCNH2HTR2ASLC6A4AR
SCHEMBL10195097 0.88 HTR2A (0.39) FFAR1KCNH2HTR2ASLC6A4SLC6A3
SCHEMBL10195183 0.87 PGR (0.37) PGR
SCHEMBL16181151 0.87 HTR2A (0.36) KCNH2HTR2ASLC6A4MRGPRX4ESRRA
SCHEMBL10195177 0.86 AR (0.39) ARMRGPRX4ESRRA
SCHEMBL10195077 0.86 HTR2A (0.36) KCNH2HTR2ASLC6A4ESRRA
SCHEMBL10195115 0.86 SLC6A4 (0.41) KCNH2HTR2ASLC6A4SLC6A3EGLN2
SCHEMBL10195373 0.85 HTR2A (0.36) KCNH2HTR2ASLC6A4ARMRGPRX4
SCHEMBL10195151 0.85 PDE4A (0.37) FFAR1EGLN2EGLN1PGR
SCHEMBL10195072 0.84 CAMK2A (0.38) KCNH2HTR2ASLC6A4SLC6A3EGLN2

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 FFAR1 1022/4885KCNH2 1267/4885HTR2A 1192/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 FFAR1 752/4885KCNH2 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.