SCHEMBL2048807

SCHEMBL2048807

Cc1ccc(Oc2nnc(Cl)cc2O)c(C2CC2)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 5/20 0.40
SLC6A4 P31645 6/20 0.36
SLC6A2 P23975 5/20 0.36
HTR1A P08908 3/20 0.36
SLC6A3 Q01959 3/20 0.33
DRD2 P14416 1/20 0.32
DRD1 P21728 1/20 0.32
PTGDR Q13258 3/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 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
SCHEMBL2044402 0.90 SLC6A2 (0.41) PTGDR2SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL2047443 0.84 HTR1A (0.41) SLC6A4SLC6A2HTR1ASLC6A3HTR2C
SCHEMBL2046678 0.81 UGT2B17 (0.30)
SCHEMBL2050143 0.80 GAA (0.42) HTR1A
SCHEMBL2050331 0.80 SLC6A2 (0.37) PTGDR2SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL2047464 0.79 HTR1A (0.32) SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL2046414 0.79 HTR1A (0.40) PTGDR2SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL2049228 0.79 ADRA2A (0.40) PTGDR2SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL2051866 0.78 PTGDR2 (0.42) PTGDR2SLC6A4SLC6A2HTR1ASLC6A3
SCHEMBL2047563 0.78 SLC6A2 (0.41) SLC6A4SLC6A2HTR1ASLC6A3

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 PTGDR2 666/4885SLC6A4 3104/4885SLC6A2 3620/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 PTGDR2 627/4885SLC6A4 3163/4885SLC6A2 3617/4885

“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.