SCHEMBL10195205

SCHEMBL10195205

CCc1ccc(Oc2ccc(C(F)(F)F)c(Cl)c2)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.35
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
BRAF P15056 2/20 0.31
HDAC1 Q13547 1/20 0.31
HTR2A P28223 4/20 0.30
SLC6A4 P31645 4/20 0.30
KCNH2 Q12809 4/20 0.30
AR P10275 2/20 0.30
CETP P11597 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
SCHEMBL10192937 0.93 MRGPRX4 (0.35) MRGPRX4THRATHRBBRAFHDAC1
SCHEMBL10195310 0.92 BRAF (0.36) BRAFHDAC1
SCHEMBL10195309 0.88 HSP90AA1 (0.41) HTR2ASLC6A4KCNH2
SCHEMBL13286527 0.87 HTR2A (0.39) HTR2ASLC6A4KCNH2AR
SCHEMBL10195104 0.87 HTR2A (0.38) HTR2ASLC6A4KCNH2
SCHEMBL10195089 0.87 THRA (0.33) THRATHRBHTR2ASLC6A4KCNH2
SCHEMBL10195200 0.86 MMP14 (0.35) THRBSLC6A4CETP
SCHEMBL10195184 0.86 HSP90AA1 (0.32)
SCHEMBL16351651 0.86 HTR2A (0.36) HTR2ASLC6A4KCNH2
SCHEMBL10195354 0.86 AR (0.41) AR

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 MRGPRX4 1286/4885THRA 2107/4885THRB 1628/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 MRGPRX4 1260/4885THRA 1640/4885THRB 1157/4885

“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.