SCHEMBL10195478

SCHEMBL10195478

CCc1ccc(Oc2ccc(C#N)c(Cl)c2)cc1C1=C(O)CC2(CCOCC2)CC1=O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 6/20 0.43
AR P10275 6/20 0.34
CYP11B1 P15538 1/20 0.33
ESRRA P11474 1/20 0.33
TRPV4 Q9HBA0 2/20 0.32
PGR P06401 2/20 0.32
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP13 P45452 1/20 0.31
MMP14 P50281 1/20 0.31

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
SCHEMBL16181204 0.87 HTR2A (0.35) MMP1MMP2MMP3MMP9MMP8
SCHEMBL10195119 0.86 MMP1 (0.36) CYP11B2MMP1MMP2MMP3MMP9
SCHEMBL10195464 0.85 AR (0.38) ARESRRA
SCHEMBL10195484 0.85 CYP11B2 (0.39) CYP11B2ARESRRATRPV4PGR
SCHEMBL10195169 0.85 HTR2A (0.36) MMP1MMP2MMP3MMP9MMP8
SCHEMBL10195479 0.84 PLA2G7 (0.32) MMP1MMP2MMP3MMP9MMP8
SCHEMBL10195477 0.83 NPC1 (0.33) MMP1MMP2MMP3MMP9MMP8
SCHEMBL16351649 0.83 LPAR1 (0.35)
SCHEMBL10195122 0.82 MAOB (0.37) MMP1MMP2MMP3MMP9MMP8
SCHEMBL10195118 0.82 MMP1 (0.35) MMP1MMP2MMP3MMP9MMP8

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 503/4885AR 2889/4885CYP11B1 385/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 CYP11B2 992/4885AR 3331/4885CYP11B1 745/4885

“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.