SCHEMBL8084614

SCHEMBL8084614

O=C(Nc1ccccc1OC(F)(F)F)C(F)(F)F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.57
▸ ANO1 Q5XXA6 5/20 0.56
▸ PDK1 Q15118 1/20 0.51
▸ PDK2 Q15119 1/20 0.51
▸ PDK3 Q15120 1/20 0.51
▸ PDK4 Q16654 1/20 0.51
▸ JAK2 O60674 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ KLK7 P49862 1/20 0.48
▸ EPHX2 P34913 1/20 0.47
▸ ATR Q13535 1/20 0.46
▸ MLYCD O95822 1/20 0.46
▸ NAMPT P43490 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ C1R P00736 1/20 0.44

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
SCHEMBL12480284 0.89 ANO1 (0.47) GAAANO1PDK1PDK2PDK3
SCHEMBL13712 0.84 GAA (0.55) GAAANO1PDK1PDK2PDK3
SCHEMBL2095943 0.84 GAA (0.55) GAAANO1PDK1PDK2PDK3
SCHEMBL2095941 0.84 GAA (0.55) GAAANO1PDK1PDK2PDK3
SCHEMBL26623202 0.83 GAA (0.48) GAAANO1PDK1PDK2PDK3
SCHEMBL16291113 0.83 GAA (0.54) GAAEPHX2NAMPT
SCHEMBL2226280 0.83 PDK1 (0.72) GAAPDK1PDK2PDK3PDK4
SCHEMBL5962103 0.83 POLB (0.56) GAAPDK1PDK2PDK3PDK4
SCHEMBL2088365 0.82 EPHX2 (0.48) GAAANO1EPHX2CYP1A2CYP2C9
SCHEMBL19483223 0.81 GAA (0.52) GAAANO1PDK1PDK2PDK3

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
JP-2000510153-A — — 2000-08-08 — — JP claimed
EP-0906315-A1 SPIRO-PIPERIDINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LTD. (GB) 1999-04-07 — — EP claimed
WO-1997049710-A1 SPIRO-PIPERIDINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS MERCK SHARP & DOHME LIMITED (GB) 1997-12-31 — — WO claimed
US-20230337677-A1 ARYL AND PYRIDYL AMIDE PESTICIDES AND COMPOSITIONS THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2023-10-26 — — 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 (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-20230337677-A1 ARYL AND PYRIDYL AMIDE PESTICIDES AND COMPOSITIONS THEREOF DDT, ACHE, AHR GAA 4686/4885ANO1 4511/4885PDK1 2357/4885

“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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