SCHEMBL10195470

SCHEMBL10195470

CCc1ccc(Oc2ccc(C#N)cc2F)cc1C1=C(O)CC2(CCOCC2)CC1=O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 1/20 0.33
HTR2A P28223 3/20 0.33
KCNH2 Q12809 3/20 0.32
SLC6A4 P31645 1/20 0.32
MAOB P27338 1/20 0.31
USP30 Q70CQ3 1/20 0.31
MAPK14 Q16539 1/20 0.31
FASN P49327 1/20 0.31
ALK Q9UM73 1/20 0.31
KDM1A O60341 1/20 0.30
EGLN2 Q96KS0 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30
EGLN3 Q9H6Z9 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
SCHEMBL10195519 0.90 AR (0.36) CYP11B2HTR2AKCNH2SLC6A4
SCHEMBL16351650 0.88 MAPK14 (0.32) HTR2AKCNH2SLC6A4MAPK14
SCHEMBL10195048 0.87 MAPK14 (0.32) MAPK14
SCHEMBL10195168 0.87 SLC6A4 (0.38) CYP11B2HTR2AKCNH2SLC6A4MAPK14
SCHEMBL10195192 0.86 ALDH1A1 (0.34) HTR2AKCNH2SLC6A4MAOBUSP30
SCHEMBL10196191 0.82 HTR2A (0.35) HTR2AKCNH2SLC6A4MAOBUSP30
SCHEMBL10195118 0.82 MMP1 (0.35) MAOB
SCHEMBL16351679 0.82 FFAR4 (0.33) HTR2AKCNH2SLC6A4EGLN1
SCHEMBL16351675 0.81 SLC6A4 (0.31) SLC6A4
SCHEMBL10195169 0.81 HTR2A (0.36) HTR2AKCNH2SLC6A4

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 7 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

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 CYP11B2 503/4885HTR2A 1192/4885KCNH2 1267/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 CYP11B2 992/4885HTR2A 1320/4885KCNH2 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.