SCHEMBL10195173

SCHEMBL10195173

CCc1ccc(Oc2ccc(Cl)cc2Cl)cc1C1=C(O)CC(C)(C)CC1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.39
SLC6A4 P31645 3/20 0.39
KCNH2 Q12809 3/20 0.39
FFAR1 O14842 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 3/20 0.38
HTT P42858 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.37
TP53 P04637 1/20 0.36
LMNA P02545 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
HIF1A Q16665 1/20 0.35
KDM4E B2RXH2 1/20 0.35
NR1I2 O75469 1/20 0.35
TTR P02766 1/20 0.35
PGR P06401 1/20 0.35
HSP90AA1 P07900 1/20 0.35
ADORA3 P0DMS8 1/20 0.35

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
SCHEMBL16351656 0.91 SMN1; SMN2 (0.37) HTR2ASLC6A4KCNH2SMN1; SMN2ALDH1A1
SCHEMBL10195172 0.91 SLC6A4 (0.41) HTR2ASLC6A4KCNH2SMN1; SMN2ALDH1A1
SCHEMBL10195111 0.90 SLC6A4 (0.40) HTR2ASLC6A4KCNH2SMN1; SMN2ALDH1A1
SCHEMBL10195106 0.88 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1HTTTP53LMNA
SCHEMBL10195482 0.88 ALDH1A1 (0.45) HTR2ASLC6A4KCNH2FFAR1SMN1; SMN2
SCHEMBL16351659 0.87 ALDH1A1 (0.38) HTR2ASLC6A4KCNH2FFAR1SMN1; SMN2
SCHEMBL10196150 0.85 HTR2A (0.42) HTR2ASLC6A4KCNH2FFAR1MRGPRX4
SCHEMBL10195322 0.85 HTR2A (0.38) HTR2ASLC6A4KCNH2FFAR1MRGPRX4
SCHEMBL10195451 0.84 SMN1; SMN2 (0.39) HTR2ASLC6A4KCNH2SMN1; SMN2ALDH1A1
SCHEMBL10195126 0.83 HTR2A (0.41) HTR2ASLC6A4KCNH2FFAR1MRGPRX4

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 HTR2A 1192/4885SLC6A4 1501/4885KCNH2 1267/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 HTR2A 1320/4885SLC6A4 1443/4885KCNH2 1805/4885

“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.