SCHEMBL2046732

SCHEMBL2046732

Oc1cc(Cl)nnc1Oc1ccccc1-c1nc2ccccc2s1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.53
RAB9A P51151 7/20 0.53
SMN1; SMN2 Q16637 7/20 0.53
NPC1 O15118 6/20 0.53
MEN1 O00255 6/20 0.53
ALDH1A1 P00352 5/20 0.53
KDM4E B2RXH2 9/20 0.49
MAPT P10636 8/20 0.49
NPSR1 Q6W5P4 2/20 0.49
GAA P10253 4/20 0.47
GLA P06280 3/20 0.47
HCRTR1 O43613 2/20 0.47
HSD17B10 Q99714 3/20 0.46
HPGD P15428 2/20 0.46
TP53 P04637 2/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
MAPK1 P28482 1/20 0.46
BLM P54132 1/20 0.46

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
SCHEMBL2051590 0.79 ADRA1A (0.41) KMT2ARAB9ASMN1; SMN2MEN1ALDH1A1
SCHEMBL2051550 0.76 NCOA1 (0.40) SMN1; SMN2ALDH1A1KDM4EMAPTNPSR1
SCHEMBL2046372 0.75 PTGS2 (0.52) KMT2ARAB9ASMN1; SMN2NPC1MEN1
SCHEMBL2048850 0.74 TP53 (0.42) KMT2ARAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL1037831 0.74 MEN1 (0.51) KMT2ARAB9ASMN1; SMN2NPC1MEN1
SCHEMBL2051376 0.73 NPSR1 (0.41) KMT2ARAB9ASMN1; SMN2NPC1MEN1
SCHEMBL19972024 0.73 SMN1; SMN2 (0.56) KMT2ARAB9ASMN1; SMN2NPC1MEN1
SCHEMBL2088159 0.72 ALDH1A1 (0.76) KMT2ARAB9ASMN1; SMN2NPC1MEN1
SCHEMBL2047260 0.72 LMNA (0.46) KMT2ARAB9ASMN1; SMN2MEN1ALDH1A1
SCHEMBL30161844 0.72 ALDH1A1 (0.76) KMT2ARAB9ASMN1; SMN2NPC1MEN1

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 KMT2A 572/4885RAB9A 2582/4885SMN1; SMN2 3918/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 KMT2A 493/4885RAB9A 3242/4885SMN1; SMN2 3931/4885

“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.