SCHEMBL6614548

SCHEMBL6614548

CC(=O)N(O)Cc1cccc(Oc2ccccc2)n1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.45
PTGS1 P23219 2/20 0.45
PTGS2 P35354 2/20 0.45
ALOX5AP P20292 1/20 0.45
TSPO P30536 1/20 0.38
HSD17B14 Q9BPX1 1/20 0.38
SYK P43405 1/20 0.37
F2 P00734 1/20 0.37
F10 P00742 1/20 0.37
PRSS1 P07477 1/20 0.37
PRSS2 P07478 1/20 0.37
PRSS3 P35030 1/20 0.37
ST14 Q9Y5Y6 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
Acetic Acid SCHEMBL11368795 0.80 P2RX3 (0.41) HSD17B14F2F10PRSS1PRSS2
SCHEMBL11275809 0.77 ALDH1A1 (0.47) HSD17B14F2F10PRSS1PRSS2
SCHEMBL10871695 0.77 FFAR1 (0.53) HSD17B14F2F10PRSS1PRSS2
SCHEMBL10653082 0.75 KDM4E (0.44) HSD17B14
SCHEMBL11275806 0.74 L3MBTL1 (0.43) HSD17B14F2F10PRSS1PRSS2
SCHEMBL10841713 0.74 F2 (0.44) HSD17B14F2F10PRSS1PRSS2
SCHEMBL11393045 0.74 MTNR1A (0.38) ALOX5PTGS1HSD17B14F2F10
SCHEMBL11175776 0.74 KCNH2 (0.44) HSD17B14F2F10PRSS1PRSS2
SCHEMBL9198043 0.74 KCNH2 (0.44) F2F10PRSS1PRSS2PRSS3
SCHEMBL2893839 0.74 F2 (0.46) HSD17B14F2F10PRSS1PRSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794336-B2 Herbicidal substituted pyridines, their preparation, and their use as herbicides and plant growth regulators AVENTIS CROP SCIENCE GMBH (DE) 2004-09-21 US claimed
EP-1401827-A2 HERBICIDAL SUBSTITUTED PYRIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS HERBICIDAL AGENTS AND PLANT GROWTH REGULATORS Bayer CropScience GmbH (DE) 2004-03-31 EP claimed
US-20030229125-A1 Herbicidal substituted pyridines, their preparation, and their use as herbicides and plant growth regulators BAYER CROPSCIENCE AG (DE) 2003-12-11 US claimed
WO-2003000679-A2 HERBICIDAL SUBSTITUTED PYRIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS HERBICIDAL AGENTS AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2003-01-03 WO claimed
US-6794336-B2 Herbicidal substituted pyridines, their preparation, and their use as herbicides and plant growth regulators AVENTIS CROP SCIENCE GMBH (DE) 2004-09-21 US disclosed
CN-1520407-A Herbicidally substituted pyridines, their preparation and their use as herbicides and plant growth regulators �Ϻ���ͨ��ѧ 2004-08-11 CN disclosed
EP-1401827-A2 HERBICIDAL SUBSTITUTED PYRIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS HERBICIDAL AGENTS AND PLANT GROWTH REGULATORS Bayer CropScience GmbH (DE) 2004-03-31 EP disclosed
EP-1401827-A2 HERBICIDAL SUBSTITUTED PYRIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS HERBICIDAL AGENTS AND PLANT GROWTH REGULATORS Bayer CropScience GmbH (DE) 2004-03-31 EP disclosed
US-20030229125-A1 Herbicidal substituted pyridines, their preparation, and their use as herbicides and plant growth regulators BAYER CROPSCIENCE AG (DE) 2003-12-11 US disclosed
US-20030229125-A1 Herbicidal substituted pyridines, their preparation, and their use as herbicides and plant growth regulators BAYER CROPSCIENCE AG (DE) 2003-12-11 US disclosed
WO-2003000679-A3 HERBICIDAL SUBSTITUTED PYRIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS HERBICIDAL AGENTS AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2003-04-24 WO disclosed
WO-2003000679-A2 HERBICIDAL SUBSTITUTED PYRIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS HERBICIDAL AGENTS AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2003-01-03 WO disclosed
WO-2003000679-A2 HERBICIDAL SUBSTITUTED PYRIDINES, METHOD FOR PRODUCING THE SAME AND THEIR USE AS HERBICIDAL AGENTS AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE GMBH (DE) 2003-01-03 WO disclosed
EP-0196184-B1 ARYL DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1992-09-16 EP disclosed
US-5036157-A Hydroxamic acid derivatives, lipoxygenase and cyclooxygenase inhibitors, anticoagulants, antiinflammatory agents BURROUGHS WELLCOME CO. 1991-07-30 US disclosed
US-4977188-A Hydroamic acid derivatives BURROUGHS WELLCOME CO. (US) 1990-12-11 US disclosed
WO-1990001929-A1 NEW MEDICAL USE THE WELLCOME FOUNDATION LIMITED (GB) 1990-03-08 WO disclosed
US-4738986-A CYCLOOXYGENASE, LIDOXYGENASE INHIBITORS BURROUGHS WELLCOME CO. (US) 1988-04-19 US disclosed
EP-0196184-A2 Aryl derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1986-10-01 EP 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 (1 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-20030229125-A1 Herbicidal substituted pyridines, their preparation, and their use as herbicides and plant growth regulators CBR3, CBR1, CYCS ALOX5 1388/4885PTGS1 916/4885PTGS2 1845/4885

“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.