SCHEMBL3333328

SCHEMBL3333328

CCOc1c(Cl)ccc(-c2cc(N)c(Cl)c(C(=O)OC)n2)c1F

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.37
MAPK9 P45984 2/20 0.37
PRKD2 Q9BZL6 2/20 0.37
KDM4E B2RXH2 2/20 0.37
PKM P14618 2/20 0.37
PRKD3 O94806 1/20 0.37
MAPK8 P45983 1/20 0.37
MAPK10 P53779 1/20 0.37
RCE1 Q9Y256 1/20 0.37
ALPL P05186 1/20 0.36
ALOX5AP P20292 2/20 0.36
FEN1 P39748 2/20 0.36
S1PR4 O95977 1/20 0.36
NQO2 P16083 1/20 0.35
CSF1R P07333 1/20 0.34
CSNK1D P48730 1/20 0.34
CNR1 P21554 1/20 0.33
GAA P10253 1/20 0.33
TSHR P16473 1/20 0.33
KLKB1 P03952 1/20 0.33

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
SCHEMBL3325100 0.92 ALPL (0.40) MAPK1MAPK9PRKD2KDM4EPKM
SCHEMBL3326935 0.92 CNR1 (0.40) KDM4EPKMRCE1ALPLALOX5AP
SCHEMBL3327666 0.92 MAPK1 (0.37) MAPK1MAPK9PRKD2KDM4EPKM
SCHEMBL3330292 0.91 KDM4E (0.36) KDM4EPKMRCE1ALPLALOX5AP
SCHEMBL3328532 0.91 S1PR4 (0.38) MAPK1MAPK9PRKD2KDM4EPKM
SCHEMBL2463882 0.89 ALOX5AP (0.39) MAPK1MAPK9PRKD2KDM4EPRKD3
SCHEMBL29442558 0.89 KDM4E (0.40) KDM4EPKMRCE1ALPLS1PR4
SCHEMBL29423657 0.89 KDM4E (0.40) KDM4EPKMRCE1ALPLS1PR4
SCHEMBL115368 0.89 KDM4E (0.40) KDM4EPKMRCE1ALPLS1PR4
SCHEMBL3329184 0.89 ALOX5AP (0.36) KDM4EPKMRCE1ALPLALOX5AP

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2060566-B1 Poly-substituted aryls DOW AGROSCIENCES LLC (US) 2016-06-08 EP claimed
EP-2060566-B1 Poly-substituted aryls DOW AGROSCIENCES LLC (US) 2016-06-08 EP disclosed
US-8962523-B2 Herbicide/safener combination BAYER CROPSCIENCE AG (DE) 2015-02-24 US disclosed
US-20150051074-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2015-02-19 US disclosed
US-20100137137-A1 HERBICIDE/SAFENER COMBINATION BAYER CROPSCIENCE AG (DE) 2010-06-03 US disclosed
EP-1973881-B1 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2009-10-28 EP disclosed
EP-2060566-A1 Poly-substituted aryls Dow AgroSciences LLC (US) 2009-05-20 EP disclosed
US-7498468-B2 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2009-03-03 US disclosed
EP-1973881-A2 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES Dow Agrosciences LLC (US) 2008-10-01 EP disclosed
US-20080051596-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-02-28 US disclosed
US-20080045734-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-02-21 US disclosed
US-7314849-B2 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2008-01-01 US disclosed
US-20070179060-A1 6-(Poly-substituted aryl)-4-aminopicolinates and their use as herbicides CORTEVA AGRISCIENCE LLC 2007-08-02 US disclosed
WO-2007082098-A2 6-(POLY-SUBSTITUTED ARYL)-4-AMINOPICOLINATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2007-07-19 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 (5 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-20080045734-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC MAPK1 4148/4885MAPK9 3378/4885PRKD2 4003/4885
US-20100137137-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 MAPK1 3831/4885MAPK9 4635/4885PRKD2 4100/4885
US-20070179060-A1 6-(Poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC MAPK1 4148/4885MAPK9 3378/4885PRKD2 4003/4885
US-20080051596-A1 6-(poly-substituted aryl)-4-aminopicolinates and their use as herbicides AAAS, DDT, AADAC MAPK1 4148/4885MAPK9 3378/4885PRKD2 4003/4885
US-20150051074-A1 HERBICIDE/SAFENER COMBINATION DDT, CYP2W1, GAP43 MAPK1 3831/4885MAPK9 4635/4885PRKD2 4100/4885

“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.