SCHEMBL10196235

SCHEMBL10196235

CCc1ccc(Oc2ncc(Cl)cc2C(F)(F)F)cc1C1=C(O)CCC1=O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 5/20 0.35
MAPK1 P28482 1/20 0.34
SCN9A Q15858 3/20 0.34
SCN5A Q14524 1/20 0.34
LMNA P02545 3/20 0.33
BCHE P06276 1/20 0.33
LIPE Q05469 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP2C9 P11712 1/20 0.33
TSHR P16473 1/20 0.33
APEX1 P27695 1/20 0.33
PTGER4 P35408 1/20 0.33
RAB9A P51151 1/20 0.32
ESR1 P03372 1/20 0.32
ALDH1A1 P00352 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL10196222 0.90 LMNA (0.37) DRD1SCN9ALMNALIPESMN1; SMN2
SCHEMBL10196114 0.87 DRD1 (0.38) DRD1MAPK1SCN9ALMNABCHE
SCHEMBL10196204 0.87 MAPK1 (0.48) DRD1MAPK1SCN9ALMNABCHE
SCHEMBL13190327 0.87 SCN9A (0.33) DRD1MAPK1SCN9ASCN5ALMNA
SCHEMBL10196203 0.85 RAB9A (0.50) LMNALIPESMN1; SMN2RAB9AALDH1A1
SCHEMBL10195467 0.83 LIPE (0.33) DRD1SCN9ASCN5ALIPE
SCHEMBL10196195 0.82 MRGPRX4 (0.35) SCN9ALMNASMN1; SMN2ALDH1A1
SCHEMBL10196202 0.82 SCN9A (0.41) SCN9ALMNALIPESMN1; SMN2RAB9A
SCHEMBL10196210 0.82 MEN1 (0.32) DRD1ALDH1A1
SCHEMBL10195603 0.81 SCN9A (0.33) DRD1MAPK1SCN9ASCN5ALMNA

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 6 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
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
WO-2010102848-A1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LIMITED (GB) 2010-09-16 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 (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 DRD1 325/4885MAPK1 2263/4885SCN9A 2224/4885

“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.