SCHEMBL23370338

SCHEMBL23370338

COc1cccc2cnn(CCCC(F)(F)F)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADORA2A P29274 3/20 0.40
▸ USP1 O94782 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.37
▸ HTT P42858 3/20 0.37
▸ HSD17B10 Q99714 3/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ GLA P06280 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CASP1 P29466 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ ATM Q13315 1/20 0.37
▸ HTR2A P28223 2/20 0.36
▸ HTR2C P28335 1/20 0.36
▸ CNR2 P34972 2/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ JAK1 P23458 1/20 0.34
▸ TYK2 P29597 1/20 0.34
▸ JAK3 P52333 1/20 0.34
▸ TLR8 Q9NR97 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
SCHEMBL23370326 0.83 ADORA2A (0.35) ADORA2AUSP1ALDH1A1SIGMAR1
SCHEMBL23370331 0.80 CYP1A2 (0.34) ADORA2AUSP1JAK2JAK1MCHR1
SCHEMBL23370339 0.80 HTR2A (0.35) HTR2AHTR2CJAK2JAK1ADRA2A
SCHEMBL24853555 0.80 CASR (0.31) ALDH1A1HTR2AHTR2C
SCHEMBL23370320 0.78 PPARG (0.36) USP1HPGDHTR2AHTR2CHTR2B
SCHEMBL24853566 0.77 HTR2A (0.35) ADORA2AHTR2AHTR2CMCHR1
SCHEMBL23361234 0.76 NPC1 (0.43) NPC1RAB9A
SCHEMBL23370317 0.75 HASPIN (0.41) ADORA2AALDH1A1HTTHSD17B10KDM4E
SCHEMBL23370329 0.74 ADORA2A (0.39) ADORA2AALDH1A1HTTHSD17B10KDM4E
SCHEMBL29907751 0.74 ADORA2A (0.39) ADORA2AALDH1A1HTTHSD17B10KDM4E

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 1751/4885USP1 3151/4885ALDH1A1 481/4885

“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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