SCHEMBL2046215

SCHEMBL2046215

CC1CCc2c(Oc3nnc(Cl)cc3O)cccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 2/20 0.34
ACHE P22303 4/20 0.33
BCHE P06276 1/20 0.33
CYP19A1 P11511 1/20 0.33
HSD11B1 P28845 1/20 0.33
DRD2 P14416 4/20 0.32
DRD4 P21917 4/20 0.32
MEN1 O00255 2/20 0.32
CYP1A2 P05177 2/20 0.32
HTR1A P08908 2/20 0.32
DRD3 P35462 2/20 0.32
HTR5A P47898 2/20 0.32
KMT2A Q03164 2/20 0.32
TSHR P16473 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA1A P35348 1/20 0.32
CYP2D6 P10635 1/20 0.32
HTR2C P28335 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 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
SCHEMBL2049772 0.81 DRD2 (0.33) ACHEDRD2HTR1AHTR2C
SCHEMBL2051865 0.78 BCL2L1 (0.33) DRD2DRD3DRD1DRD5
SCHEMBL2047443 0.78 HTR1A (0.41) MEN1HTR1AKMT2AADRA2AHTR2C
SCHEMBL2047144 0.77
SCHEMBL2046414 0.76 HTR1A (0.40) MEN1CYP1A2HTR1ADRD3KMT2A
SCHEMBL2046931 0.76 BCL2L1 (0.44)
SCHEMBL2049347 0.76 BCL2L1 (0.41)
SCHEMBL2051868 0.76 KDM1A (0.35) HTR1AHTR2C
SCHEMBL2049228 0.76 ADRA2A (0.40) MEN1CYP1A2HTR1ADRD3KMT2A
SCHEMBL2051866 0.75 PTGDR2 (0.42) MEN1CYP1A2HTR1ADRD3KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 PTK2 3116/4885ACHE 48/4885BCHE 432/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 PTK2 3039/4885ACHE 68/4885BCHE 485/4885

“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.