SCHEMBL10195666

SCHEMBL10195666

CC1(C)OC(C)(C)C(O)=C(c2cc(Oc3ncc(Cl)cc3C(F)(F)F)ccc2C2CC2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.33
MAPK1 P28482 1/20 0.33
SCN9A Q15858 4/20 0.33
SCN5A Q14524 1/20 0.33
BACE1 P56817 1/20 0.32
DGAT2 Q96PD7 3/20 0.32
PTGER4 P35408 2/20 0.32
DRD1 P21728 1/20 0.32
ALOX5AP P20292 2/20 0.31
FEN1 P39748 2/20 0.31
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
CETP P11597 1/20 0.30
BRAF P15056 1/20 0.30
KDR P35968 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
SCHEMBL10195656 0.91 RAB9A (0.37) RAB9ASCN9ASCN5ADRD1ALOX5AP
SCHEMBL10195641 0.89 MAPK1 (0.45) RAB9AMAPK1SCN9ADRD1PPARG
SCHEMBL10195639 0.87 RAB9A (0.49) RAB9ASCN9A
SCHEMBL10195261 0.85 MAPK1 (0.34) RAB9AMAPK1SCN9ASCN5ABACE1
SCHEMBL10195633 0.84 MRGPRX4 (0.32)
SCHEMBL10195606 0.81 MAOB (0.37) MAPK1
SCHEMBL16351667 0.80 BRAF (0.31) BRAFKDR
SCHEMBL10195620 0.80 SOS1 (0.34) SCN9APPARG
SCHEMBL10195653 0.79 SCN9A (0.37) SCN9A
SCHEMBL10195632 0.79 FFAR1 (0.44)

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 RAB9A 2665/4885MAPK1 2927/4885SCN9A 1880/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 RAB9A 3044/4885MAPK1 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.