SCHEMBL17376705

SCHEMBL17376705

COc1cccc(OC)c1C1C(=O)CCCC1=O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCRTR2 O43614 8/20 0.43
HCRTR1 O43613 7/20 0.43
ACHE P22303 1/20 0.41
POLL Q9UGP5 1/20 0.41
ABCB1 P08183 1/20 0.40
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39

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
SCHEMBL11224539 0.89 CRHBP (0.43) HCRTR2HCRTR1
SCHEMBL11229583 0.89 HCRTR1 (0.39) HCRTR2HCRTR1ACHEPOLL
SCHEMBL17382579 0.89 TP53 (0.46) HCRTR2HCRTR1ACHEPOLL
SCHEMBL15001063 0.81 CRHBP (0.45) HCRTR2HCRTR1ACHEPOLL
SCHEMBL17376649 0.74 ALDH1A1 (0.32)
SCHEMBL21985342 0.74 HCRTR1 (0.46) HCRTR2HCRTR1POLL
SCHEMBL16937274 0.71 DDB1 (0.52)
SCHEMBL4531809 0.70 PDE4A (0.50) HCRTR2HCRTR1ACHEPOLLDRD2
SCHEMBL9052842 0.70 DRD2 (0.45) HCRTR2HCRTR1ACHEDRD2
SCHEMBL15821759 0.69 CA1 (0.35)

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106458958-B Herbicidal propynyl-phenyl compounds 先正达参股股份有限公司 2020-07-10 CN disclosed
US-10662138-B2 Herbicidal propynyl-phenyl compounds SYNGENTA PARTICIPATIONS AG (CH) 2020-05-26 US disclosed
US-10662138-B2 Herbicidal propynyl-phenyl compounds SYNGENTA PARTICIPATIONS AG (CH) 2020-05-26 US disclosed
EP-3160950-B1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2020-05-13 EP disclosed
EP-3160950-B1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2020-05-13 EP disclosed
US-20170183281-A1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-06-29 US disclosed
US-20170183281-A1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-06-29 US disclosed
US-20170183281-A1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2017-06-29 US disclosed
EP-3160950-A1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS Syngenta Participations AG (CH) 2017-05-03 EP disclosed
WO-2015197468-A1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2015-12-30 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-10662138-B2 Herbicidal propynyl-phenyl compounds CBR3, CBR1, CNPY3 HCRTR2 403/4885HCRTR1 94/4885ACHE 1073/4885
US-20170183281-A1 HERBICIDAL PROPYNYL-PHENYL COMPOUNDS CBR3, CBR1, CNPY3 HCRTR2 403/4885HCRTR1 94/4885ACHE 1073/4885

“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.