SCHEMBL10195160

SCHEMBL10195160

CCc1ccc(Oc2ccccn2)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.40
DRD1 P21728 2/20 0.36
BACE1 P56817 1/20 0.34
PPARG P37231 1/20 0.34
IP6K1 Q92551 2/20 0.34
IP6K3 Q96PC2 2/20 0.34
IP6K2 Q9UHH9 2/20 0.34
CHRM5 P08912 1/20 0.34
SCN7A Q01118 4/20 0.33
KCNH2 Q12809 4/20 0.33
SCN5A Q14524 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN8A Q9UQD0 1/20 0.33
EGLN2 Q96KS0 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
MGLL Q99685 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
GRM5 P41594 1/20 0.32
TLR4 O00206 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
SCHEMBL10195254 0.89 KDM4E (0.40) PTGS2L3MBTL1
SCHEMBL10195285 0.87 KMT2A (0.38) PTGS2BACE1HRH3
SCHEMBL10195167 0.87 DRD1 (0.36) PTGS2DRD1PPARG
SCHEMBL10195296 0.86 PPARG (0.35) PPARG
SCHEMBL10195284 0.85 PDE4B (0.30)
SCHEMBL10195201 0.85 KMO (0.33)
SCHEMBL10195281 0.84 HTT (0.41) L3MBTL1
SCHEMBL10195266 0.84 PPARG (0.35) PTGS2PPARGEGLN1
SCHEMBL10195135 0.84 CHRM5 (0.36) CHRM5
SCHEMBL10195272 0.84 NPC1 (0.38) BACE1SCN7AKCNH2MGLLL3MBTL1

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 PTGS2 3601/4885DRD1 405/4885BACE1 1253/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 PTGS2 3414/4885DRD1 325/4885BACE1 1901/4885

“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.