SCHEMBL10196133

SCHEMBL10196133

CCc1ccc(Oc2ccc(Cl)cc2F)cc1C1=C(O)C2C(C1=O)[C@H]1CC[C@@H]2CC1

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 9/20 0.37
KCNH2 Q12809 7/20 0.37
HTR2A P28223 6/20 0.37
HIF1A Q16665 1/20 0.37
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
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 4/20 0.33
FPR2 P25090 2/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
MAPK14 Q16539 1/20 0.32
BRAF P15056 1/20 0.32
KDR P35968 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
SCHEMBL13190686 1.00 SLC6A4 (0.37) SLC6A4KCNH2HTR2AHIF1AHTR2C
SCHEMBL10196120 0.96 SLC6A4 (0.36) SLC6A4KCNH2HTR2AHIF1AHTR2C
SCHEMBL10196171 0.90 HTR2A (0.39) SLC6A4KCNH2HTR2AHIF1ASLC6A2
SCHEMBL19070669 0.89 MAPK14 (0.32) KCNH2MAPK14
SCHEMBL10196143 0.89 MAPK14 (0.32) KCNH2MAPK14
SCHEMBL10196136 0.88 HIF1A (0.35) SLC6A4KCNH2HTR2AHIF1AHTR2C
SCHEMBL19071560 0.88 HIF1A (0.35) SLC6A4KCNH2HTR2AHIF1AHTR2C
SCHEMBL19071632 0.87 MAOA (0.36) SLC6A4KCNH2HTR2A
SCHEMBL10196134 0.87 MAOA (0.36) SLC6A4KCNH2HTR2A
SCHEMBL10196106 0.86 HTR2A (0.38) SLC6A4KCNH2HTR2AHIF1ASLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US 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 (1 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-20120021912-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.