SCHEMBL2051865

SCHEMBL2051865

Oc1cc(Cl)nnc1Oc1cccc2c1CC2

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BCL2L1 Q07817 1/20 0.33
BAD Q92934 1/20 0.33
SCN9A Q15858 1/20 0.32
IDO1 P14902 2/20 0.31
BRAF P15056 1/20 0.31
CARM1 Q86X55 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
RXRA P19793 1/20 0.30
LMNA P02545 1/20 0.30
ADRB2 P07550 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
DRD2 P14416 2/20 0.30
DRD1 P21728 2/20 0.30
DRD5 P21918 2/20 0.30
DRD3 P35462 2/20 0.30

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
SCHEMBL2049347 0.92 BCL2L1 (0.41) BCL2L1BADSCN9AIDO1BRAF
SCHEMBL2046931 0.92 BCL2L1 (0.44) BCL2L1BADSCN9AIDO1BRAF
SCHEMBL2046406 0.82 LMNA (0.31) LMNA
SCHEMBL2047088 0.79 RXRA (0.35) RXRALMNAADRB2SMN1; SMN2
SCHEMBL2048073 0.79 PARP1 (0.37)
SCHEMBL2046137 0.79 MTNR1B (0.42) DRD1
SCHEMBL2046215 0.78 PTK2 (0.34) DRD2DRD1DRD5DRD3
SCHEMBL2049772 0.78 DRD2 (0.33) DRD2
SCHEMBL2048258 0.78
SCHEMBL2048259 0.78

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 BCL2L1 340/4885BAD 2549/4885SCN9A 1564/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 BCL2L1 240/4885BAD 2633/4885SCN9A 1682/4885

“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.