SCHEMBL10196025

SCHEMBL10196025

CCc1ccc(Oc2ccc(Cl)c(Cl)c2)cc1C1=C(O)CCC1=O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.41
FFAR1 O14842 1/20 0.38
LIPG Q9Y5X9 1/20 0.37
KMO O15229 1/20 0.36
HTR2A P28223 14/20 0.36
SLC6A4 P31645 13/20 0.36
KCNH2 Q12809 13/20 0.36
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP3A5 P20815 1/20 0.34
CYP2C19 P33261 1/20 0.34
HIF1A Q16665 1/20 0.34

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
SCHEMBL10196168 0.90 HTR2A (0.40) HTR2ASLC6A4KCNH2CYP3A4CYP2C19
SCHEMBL10196155 0.89 MAOA (0.39) HTR2ASLC6A4KCNH2HIF1A
SCHEMBL10196192 0.87 AR (0.40)
SCHEMBL10196195 0.87 MRGPRX4 (0.35) HTR2ASLC6A4KCNH2
SCHEMBL10196196 0.86 MAPK1 (0.35) CYP3A4CYP2D6CYP2C19
SCHEMBL10196167 0.84 MAOB (0.42)
SCHEMBL10196154 0.84 LTB4R (0.37) LIPGCYP2C19HIF1A
SCHEMBL10196150 0.84 HTR2A (0.42) HSP90AA1FFAR1HTR2ASLC6A4KCNH2
SCHEMBL12119086 0.84 HSD17B1 (0.42) SLC6A4SLC6A2SLC6A3
SCHEMBL10195170 0.83 HTR2A (0.38) HTR2ASLC6A4KCNH2CYP3A4CYP2C19

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 HSP90AA1 892/4885FFAR1 752/4885LIPG 4193/4885

“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.