SCHEMBL407119

SCHEMBL407119

CCc1ccc(O)cc1C1C(=O)C2C3CCC(CC3)C2C1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 1/20 0.36
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 2/20 0.35
NQO2 P16083 1/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
ESR1 P03372 3/20 0.33
ESR2 Q92731 3/20 0.33
TYR P14679 2/20 0.33
ANPEP P15144 1/20 0.33
DPP4 P27487 1/20 0.33
TSHR P16473 2/20 0.32
CYP2D6 P10635 1/20 0.32
CYP26A1 O43174 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
MEN1 O00255 1/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 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
SCHEMBL406669 0.96 SLC6A2 (0.41) HSD17B3SLC6A2SLC6A4SLC6A3NQO2
SCHEMBL403031 0.81 LMNA (0.38) TSHRTP53MAPT
SCHEMBL446693 0.81 LMNA (0.38) TSHRTP53MAPT
SCHEMBL407231 0.78 LMNA (0.35) TSHRMEN1TP53MAPTKMT2A
SCHEMBL405703 0.78 LMNA (0.35) TSHRMEN1TP53MAPTKMT2A
SCHEMBL448707 0.78 LMNA (0.35) TSHRMEN1TP53MAPTKMT2A
SCHEMBL452406 0.77 TAAR1 (0.36) SLC6A3CYP2D6MEN1TP53CYP3A4
SCHEMBL452407 0.77 TAAR1 (0.36) SLC6A3CYP2D6MEN1TP53CYP3A4
SCHEMBL449376 0.74 TAAR1 (0.34) MEN1KMT2A
SCHEMBL449377 0.74 TAAR1 (0.34) MEN1KMT2A

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 5 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-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
EP-2389066-A1 CYCLOPENTADIONE DERIVED HERBICIDES Syngenta Limited (GB) 2011-11-30 EP 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 HSD17B3 497/4885SLC6A2 2164/4885SLC6A4 1443/4885

“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.