SCHEMBL23370302

SCHEMBL23370302

COc1cccc2c(B3OC(C)(C)C(C)(C)O3)nn(CCCC(F)(F)F)c12

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 3/20 0.35
▸ CNR2 P34972 4/20 0.33
▸ CNR1 P21554 3/20 0.32
▸ HASPIN Q8TF76 1/20 0.31
▸ CYP19A1 P11511 1/20 0.30
▸ NQO2 P16083 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
SCHEMBL23370317 0.79 HASPIN (0.41) ADORA2ACNR2HASPINCYP19A1NQO2
SCHEMBL23370329 0.78 ADORA2A (0.39) ADORA2ACNR2HASPINCYP19A1NQO2
SCHEMBL29907751 0.78 ADORA2A (0.39) ADORA2ACNR2HASPINCYP19A1NQO2
SCHEMBL23370303 0.75 ADORA2A (0.37) ADORA2ACNR2HASPINCYP19A1NQO2
SCHEMBL29907756 0.70 CNR2 (0.50) ADORA2ACNR2CNR1
SCHEMBL29617945 0.68 ESR1 (0.34) ADORA2A
SCHEMBL23370338 0.68 ADORA2A (0.40) ADORA2ACNR2
SCHEMBL23361234 0.68 NPC1 (0.43) —
SCHEMBL31676282 0.65 LPL (0.36) —
SCHEMBL24853566 0.64 HTR2A (0.35) ADORA2AHASPIN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002357-A1 7-PYRIMIDINE-2-YL-OXY-INDAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2023-01-05 — — US disclosed
WO-2022207482-A1 HERBICIDAL COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2022-10-06 — — WO disclosed
EP-4058444-A1 7-PYRIMIDINE-2-YL-OXY-INDAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES Syngenta Crop Protection AG (CH) 2022-09-21 — — EP disclosed
WO-2021094416-A1 7-PYRIMIDINE-2-YL-OXY-INDAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES SYNGENTA CROP PROTECTION AG (CH) 2021-05-20 — — WO 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 (1 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-20230002357-A1 7-PYRIMIDINE-2-YL-OXY-INDAZOLE DERIVATIVES AND THEIR USE AS HERBICIDES AZI2, PDXK, DPYD ADORA2A 1751/4885CNR2 1330/4885CNR1 1603/4885

“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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