SCHEMBL23370330

SCHEMBL23370330

FC(F)(F)CCCn1nc(C(F)(F)F)c2cccc(Oc3ncc(Cl)cn3)c21

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 4/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ RXRA P19793 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ HPGD P15428 1/20 0.30
▸ ADORA2A P29274 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
SCHEMBL24854569 0.91 PTGDR2 (0.32) ESR1L3MBTL1ADORA2A
SCHEMBL24854251 0.90 PTGDR2 (0.33) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL29814445 0.89 CYP1A2 (0.33) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL23370304 0.89 CYP1A2 (0.33) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL24853568 0.88 CYP1A2 (0.32) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL29814635 0.88 ESR1 (0.33) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL23370308 0.88 ESR1 (0.33) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL23370440 0.88 CYP1A2 (0.37) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL24854239 0.86 CYP1A2 (0.33) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6
SCHEMBL24853757 0.86 ADORA2A (0.34) ESR1L3MBTL1CYP1A2CYP3A4CYP2D6

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
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-2022092084-A1 FUSED HETEROCYCLE DERIVATIVE AND HERBICIDE CONTAINING SAME AS ACTIVE INGREDIENT クミアイ化学工業株式会社 2022-05-05 — — WO 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 ESR1 4145/4885L3MBTL1 1821/4885CYP1A2 30/4885

“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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