SCHEMBL2049429

SCHEMBL2049429

Oc1cc(Cl)nnc1Oc1cccc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.47
ALDH1A1 P00352 4/20 0.44
GAA P10253 3/20 0.44
HSD17B10 Q99714 2/20 0.44
PGR P06401 1/20 0.44
PTGS1 P23219 1/20 0.44
MAPK1 P28482 1/20 0.44
ESRRA P11474 1/20 0.43
PIN1 Q13526 1/20 0.43
MAPT P10636 3/20 0.42
HTT P42858 2/20 0.42
SIRT2 Q8IXJ6 1/20 0.39
SIRT1 Q96EB6 1/20 0.39
SIRT3 Q9NTG7 1/20 0.39
KDM1A O60341 1/20 0.39
SCN9A Q15858 2/20 0.38
CYP1A2 P05177 1/20 0.38
KDM4E B2RXH2 4/20 0.37
DAO P14920 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL2048850 0.83 TP53 (0.42) HPGDALDH1A1GAAHSD17B10MAPK1
SCHEMBL2047088 0.81 RXRA (0.35) HPGDALDH1A1HSD17B10MAPK1MAPT
SCHEMBL2047260 0.81 LMNA (0.46) HPGDALDH1A1MAPTHTTKMT2A
SCHEMBL2053013 0.80 CA1 (0.44) HPGDALDH1A1GAAHSD17B10MAPK1
SCHEMBL2051725 0.80 CA1 (0.40) HPGDALDH1A1GAAHSD17B10PGR
SCHEMBL2047940 0.80 MEN1 (0.47) HPGDALDH1A1GAAMAPTHTT
SCHEMBL2051721 0.79 KDM4E (0.48) HPGDALDH1A1GAAHSD17B10MAPK1
SCHEMBL2048758 0.79 ALDH1A1 (0.37) ALDH1A1GAAKDM4EPOLBKMT2A
SCHEMBL2051301 0.79 LMNA (0.40) HPGDALDH1A1GAAHSD17B10MAPK1
SCHEMBL2047100 0.79 ALDH1A1 (0.41) HPGDALDH1A1MAPTSCN9ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1543455-B 3-phenoxy-4-pyridazinol derivatives and herbicidal compositions containing the same SANKYO AGRO CO LTD 2012-07-11 CN disclosed
US-7964531-B2 3-phenoxy-4-pyridazinol derivatives and herbicidal composition containing the same MITSUI CHEMICALS AGRO, INC. (JP) 2011-06-21 US disclosed
US-20100041555-A1 3-Phenoxy-4-pyridazinol derivatives and herbicidal composition containing the same MITSUI CHEMICALS AGRO, INC. (JP) 2010-02-18 US disclosed
US-7608563-B2 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same MITSUI AGRO CHEMICALS, INC. (JP) 2009-10-27 US disclosed
EP-1426365-B9 3-PHENOXY-4-PYRIDAZINOL DERIVATIVE AND HERBICIDE COMPOSITION CONTAINING THE SAME MITSUI CHEMICALS AGRO INC (JP) 2009-10-21 EP disclosed
EP-1426365-B1 3-PHENOXY-4-PYRIDAZINOL DERIVATIVE AND HERBICIDE COMPOSITION CONTAINING THE SAME SANKYO AGRO CO LTD (JP) 2009-07-15 EP disclosed
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same SANKYO AGRO COMPANY, LIMITED (JP) 2005-02-17 US disclosed
CN-1543455-A 3-phenoxy-4-pyridazinol derivatives and herbicidal compositions containing the same 三共农业株式会社 2004-11-03 CN disclosed
EP-1426365-A1 3-PHENOXY-4-PYRIDAZINOL DERIVATIVE AND HERBICIDE COMPOSITION CONTAINING THE SAME Sankyo Agro Company, Limited (JP) 2004-06-09 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 (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-20100041555-A1 3-Phenoxy-4-pyridazinol derivatives and herbicidal composition containing the same CBR3, DDT, CBR1 HPGD 1537/4885ALDH1A1 447/4885GAA 3326/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 HPGD 1885/4885ALDH1A1 762/4885GAA 3492/4885

“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.