SCHEMBL11029583

SCHEMBL11029583

COc1c(Cl)ccc(-c2cc(N)c(Cl)c(C(=O)OCc3ccccc3)n2)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.42
GAA P10253 1/20 0.41
MAPT P10636 3/20 0.40
KDM4E B2RXH2 3/20 0.40
MAOB P27338 2/20 0.40
ADORA2A P29274 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAOA P21397 1/20 0.40
ADORA2B P29275 1/20 0.40
ADORA1 P30542 1/20 0.40
PRKCZ Q05513 1/20 0.40
POLB P06746 1/20 0.39
THRB P10828 1/20 0.39
KMT2A Q03164 1/20 0.38
PDE4D Q08499 1/20 0.37

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
SCHEMBL11940261 0.93 ALOX5AP (0.44) DHODHGAAMAPTKDM4EMAOB
SCHEMBL11940246 0.85 MAPT (0.39) DHODHMAPTALDH1A1POLBTHRB
SCHEMBL11028655 0.84 DHODH (0.40) DHODHMAPTALDH1A1KMT2A
SCHEMBL11940260 0.84 NPC1 (0.41) GAAALDH1A1KMT2APDE4D
SCHEMBL16938723 0.84 DHODH (0.36) DHODHGAAMAPTKDM4EMAOB
SCHEMBL30481033 0.84 ALPL (0.43) GAAMAPTKDM4EALDH1A1KMT2A
SCHEMBL3326424 0.84 ALPL (0.43) GAAMAPTKDM4EALDH1A1KMT2A
SCHEMBL694541 0.82 ALDH1A1 (0.43) KDM4EALDH1A1
SCHEMBL694228 0.80 ALOX5AP (0.42) ALDH1A1
SCHEMBL679113 0.79 PRKCZ (0.36) GAAMAPTKDM4EALDH1A1PRKCZ

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2899182-B1 Arylalkyl esters of 4-aminopicolinates and their use as herbicides DOW AGROSCIENCES LLC (US) 2018-01-10 EP disclosed
US-9169217-B2 Arylalkyl esters of 4-amino-6-(substituted phenyl)-picolinates and 6-amino-2-(substituted phenyl)-pyrimidinecarboxylates and their use as selective herbicides for crops DOW AGROSCIENCES LLC (US) 2015-10-27 US disclosed
EP-2899182-A1 Arylalkyl esters of 4-aminopicolinates and their use as herbicides Dow AgroSciences LLC (US) 2015-07-29 EP disclosed
EP-2899182-A1 Arylalkyl esters of 4-aminopicolinates and their use as herbicides Dow AgroSciences LLC (US) 2015-07-29 EP disclosed
US-20150025238-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)-PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-PYRIMIDINECARBOXYLATES AND THEIR USE AS SELECTIVE HERBICIDES FOR CROPS DOW AGROSCIENCES LLC (US) 2015-01-22 US disclosed
US-8883688-B2 Arylalkyl esters of 4-amino-6-(substituted phenyl)-picolinates and 6-amino-2-(substituted phenyl)-pyrimidinecarboxylates and their use as selective herbicides for crops DOW AGROSCIENCES, LLC. (US) 2014-11-11 US disclosed
US-8883688-B2 Arylalkyl esters of 4-amino-6-(substituted phenyl)-picolinates and 6-amino-2-(substituted phenyl)-pyrimidinecarboxylates and their use as selective herbicides for crops DOW AGROSCIENCES, LLC. (US) 2014-11-11 US disclosed
US-8883688-B2 Arylalkyl esters of 4-amino-6-(substituted phenyl)-picolinates and 6-amino-2-(substituted phenyl)-pyrimidinecarboxylates and their use as selective herbicides for crops DOW AGROSCIENCES, LLC. (US) 2014-11-11 US disclosed
EP-2667716-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-4-PYRIMIDINECARBOXYLATES AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 2013-12-04 EP disclosed
WO-2012103042-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-4-PYRIMIDINECARBOXYLATES AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 2012-08-02 WO disclosed
US-20120190551-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)-PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-PYRIMIDINECARBOXYLATES AND THEIR USE AS SELECTIVE HERBICIDES FOR CROPS DOW AGROSCIENCES LLC (US) 2012-07-26 US disclosed
US-20120190551-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)-PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-PYRIMIDINECARBOXYLATES AND THEIR USE AS SELECTIVE HERBICIDES FOR CROPS DOW AGROSCIENCES LLC (US) 2012-07-26 US disclosed
US-20120190551-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)-PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-PYRIMIDINECARBOXYLATES AND THEIR USE AS SELECTIVE HERBICIDES FOR CROPS DOW AGROSCIENCES LLC (US) 2012-07-26 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-20120190551-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)-PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-PYRIMIDINECARBOXYLATES AND THEIR USE AS SELECTIVE HERBICIDES FOR CROPS PLPBP, AADAC, HPD DHODH 420/4885GAA 2379/4885MAPT 1630/4885
US-20150025238-A1 ARYLALKYL ESTERS OF 4-AMINO-6-(SUBSTITUTED PHENYL)-PICOLINATES AND 6-AMINO-2-(SUBSTITUTED PHENYL)-PYRIMIDINECARBOXYLATES AND THEIR USE AS SELECTIVE HERBICIDES FOR CROPS PLPBP, AADAC, HPD DHODH 420/4885GAA 2379/4885MAPT 1630/4885

“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.