SCHEMBL23309725

SCHEMBL23309725

CNC(=O)c1cc(F)nc(F)c1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.43
▸ PLK1 P53350 1/20 0.37
▸ KLKB1 P03952 1/20 0.34
▸ NUDT1 P36639 1/20 0.34
▸ AR P10275 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ MTNR1A P48039 1/20 0.33
▸ JAK2 O60674 2/20 0.33
▸ JAK1 P23458 2/20 0.33
▸ TYK2 P29597 2/20 0.33
▸ PDE4D Q08499 2/20 0.33
▸ ACSS2 Q9NR19 1/20 0.33
▸ CFTR P13569 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ BAZ2B Q9UIF8 1/20 0.33
▸ SPR P35270 1/20 0.32
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32

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
SCHEMBL23309640 0.81 DHODH (0.39) KLKB1JAK2
SCHEMBL23309530 0.81 KLKB1 (0.39) KLKB1JAK2JAK1TYK2HPGD
SCHEMBL23309580 0.81 KLKB1 (0.41) GAAKLKB1ARJAK2JAK1
SCHEMBL23309718 0.81 POLB (0.49) GAAARMAOAMAOBALDH1A1
SCHEMBL23309632 0.80 KDM4E (0.36) KLKB1HSD17B10CASP1ALDH1A1
SCHEMBL23309730 0.79 KMT2A (0.47) GAAMAOAMAOBALDH1A1
SCHEMBL23309637 0.78 POLB (0.44) GAAKLKB1HSD17B10PDE4DALDH1A1
SCHEMBL23309619 0.78 NPC1 (0.40) GAAHSD17B10CFTRCASP1ALDH1A1
SCHEMBL23309726 0.77 ALDH1A1 (0.40) HSD17B10ALDH1A1HPGD
SCHEMBL3387152 0.76 KEAP1 (0.42) GAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210120817-A1 PLANT DISEASE CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2021-04-29 — — 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-20210120817-A1 PLANT DISEASE CONTROL AGENT BROX, ALG1, CTRL GAA 75/4885PLK1 3100/4885KLKB1 4243/4885

“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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