SCHEMBL2047147

SCHEMBL2047147

CSc1ccccc1Oc1nnc(Cl)cc1O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
SLC6A3 Q01959 2/20 0.38
ALDH1A1 P00352 6/20 0.36
KDM4E B2RXH2 5/20 0.36
MAPT P10636 5/20 0.36
KMT2A Q03164 4/20 0.36
HPGD P15428 4/20 0.36
HSD17B10 Q99714 4/20 0.36
GAA P10253 3/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
POLB P06746 2/20 0.36
ALOX15 P16050 2/20 0.36
L3MBTL1 Q9Y468 3/20 0.36
MEN1 O00255 2/20 0.36
RAB9A P51151 2/20 0.36
TSHR P16473 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
AR P10275 1/20 0.35
PKM P14618 1/20 0.34

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
SCHEMBL2048264 0.86 SLC6A2 (0.40) SLC6A2SLC6A4SLC6A3ALDH1A1KDM4E
SCHEMBL2046102 0.85 ALDH1A1 (0.34) ALDH1A1L3MBTL1RAB9APKM
SCHEMBL2048850 0.83 TP53 (0.42) ALDH1A1KDM4EMAPTKMT2AHPGD
SCHEMBL2047260 0.81 LMNA (0.46) SLC6A2SLC6A4SLC6A3ALDH1A1MAPT
SCHEMBL2047940 0.80 MEN1 (0.47) SLC6A2SLC6A4SLC6A3ALDH1A1KDM4E
SCHEMBL2053013 0.80 CA1 (0.44) ALDH1A1KDM4EMAPTKMT2AHPGD
SCHEMBL2051725 0.80 CA1 (0.40) SLC6A2SLC6A3ALDH1A1MAPTKMT2A
SCHEMBL2048758 0.79 ALDH1A1 (0.37) ALDH1A1KDM4EKMT2AGAASMN1; SMN2
SCHEMBL2051301 0.79 LMNA (0.40) ALDH1A1KDM4EMAPTKMT2AHPGD
SCHEMBL2049660 0.79 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTKMT2AHPGD

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 SLC6A2 3620/4885SLC6A4 3104/4885SLC6A3 1443/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 SLC6A2 3617/4885SLC6A4 3163/4885SLC6A3 1647/4885

“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.