SCHEMBL950412

SCHEMBL950412

Cc1cc(C)c2c(c1)COC(c1cc(C(F)(F)F)nn1-c1ncccc1Cl)=[N+]2[O-]

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 1/20 0.35
▸ NR3C2 P08235 6/20 0.34
▸ NR3C1 P04150 4/20 0.34
▸ PGR P06401 4/20 0.34
▸ AR P10275 1/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ PTGS2 P35354 4/20 0.32
▸ RXRA P19793 3/20 0.32
▸ NR1H2 P55055 3/20 0.32
▸ NR1H3 Q13133 3/20 0.32
▸ PTGS1 P23219 2/20 0.32
▸ HSD11B1 P28845 1/20 0.32
▸ TRPV1 Q8NER1 1/20 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
SCHEMBL952307 0.92 OPRL1 (0.34) OPRL1NR3C2NR3C1PGRAR
SCHEMBL950991 0.87 HSD11B1 (0.36) OPRL1NR3C2KDM4EL3MBTL1MEN1
SCHEMBL954789 0.87 KDM4E (0.35) OPRL1NR3C2KDM4EL3MBTL1MEN1
SCHEMBL1468494 0.85 KDM4E (0.36) OPRL1NR3C2NR3C1PGRAR
SCHEMBL950683 0.84 PTGS2 (0.33) OPRL1NR3C2KDM4EL3MBTL1MEN1
SCHEMBL950738 0.84 PTGS2 (0.33) OPRL1NR3C2KDM4EL3MBTL1MEN1
SCHEMBL952893 0.84 KDM4E (0.33) OPRL1NR3C2KDM4EL3MBTL1MEN1
SCHEMBL952345 0.83 KDM4E (0.37) OPRL1NR3C2KDM4EL3MBTL1MEN1
SCHEMBL951090 0.83 PDPK1 (0.34) OPRL1NR3C2KDM4EL3MBTL1MEN1
SCHEMBL951621 0.82 OPRL1 (0.35) OPRL1NR3C2NR3C1PGRAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7968573-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-28 — — US disclosed
EP-1937664-B1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL CO (JP) 2011-06-15 — — EP disclosed
US-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME IKEGAMI HIROSHI 2011-03-24 — — US disclosed
US-7867949-B2 Hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-11 — — US disclosed
US-20090181956-A1 Hydrazide Compound and Pesticidal Use of the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-16 — — US 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-20110071291-A1 HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME ACHE, H1-2, H1-0 OPRL1 3235/4885NR3C2 3510/4885NR3C1 4164/4885
US-20090181956-A1 Hydrazide Compound and Pesticidal Use of the Same ACHE, DDT, CAT OPRL1 3704/4885NR3C2 3760/4885NR3C1 4348/4885

“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.

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