SCHEMBL2051703

SCHEMBL2051703

Cc1cccc(C2CC2)c1Oc1nnc(Cl)cc1OC(=O)N(c1ccccc1)c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 6/20 0.34
PTGDR Q13258 3/20 0.34
SYK P43405 1/20 0.34
RORC P51449 1/20 0.34
LCK P06239 1/20 0.33
SRC P12931 1/20 0.33
KDR P35968 1/20 0.33
MAPK14 Q16539 1/20 0.33
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CHRM4 P08173 4/20 0.33
CHRM3 P20309 4/20 0.33
CHRM5 P08912 3/20 0.33
CHRM1 P11229 3/20 0.33
RIPK1 Q13546 1/20 0.33
PTGER1 P34995 1/20 0.32
PTGER4 P35408 1/20 0.32
PTGER3 P43115 1/20 0.32
PTGER2 P43116 1/20 0.32

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
SCHEMBL2049653 0.92 LIPE (0.39) SYKL3MBTL1RIPK1NPSR1
SCHEMBL2045992 0.88 ACHE (0.39) SYKRORCHTR1ASLC6A2SLC6A4
SCHEMBL2051441 0.87 BCHE (0.34) SYKRORCHTR1ASLC6A2SLC6A4
SCHEMBL2044284 0.86 LMNA (0.37) L3MBTL1HTR1ASLC6A2SLC6A4TSHR
SCHEMBL2046595 0.86 HTR1A (0.32) SYKRORCHTR1ASLC6A2SLC6A4
SCHEMBL2050213 0.85 ACHE (0.39) L3MBTL1
SCHEMBL2046831 0.85 KMT2A (0.36) RORCHTR1ASLC6A2SLC6A4
SCHEMBL2046017 0.85 HTR1A (0.34) SYKRORCHTR1ASLC6A2SLC6A4
SCHEMBL2046452 0.85 KDM4E (0.40) SYKRORCTDP1L3MBTL1RIPK1
SCHEMBL2051856 0.85 CNR2 (0.35) SYKRORCHTR1ASLC6A2SLC6A4

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 PTGIR 2632/4885PTGDR 426/4885SYK 2615/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 PTGIR 2866/4885PTGDR 447/4885SYK 2320/4885

“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.