SCHEMBL6716559

SCHEMBL6716559

Cc1ccccc1NOC(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 3/20 0.43
▸ MAPT P10636 3/20 0.43
▸ PDK1 Q15118 1/20 0.42
▸ PDK2 Q15119 1/20 0.42
▸ PDK3 Q15120 1/20 0.42
▸ PDK4 Q16654 1/20 0.42
▸ RAB9A P51151 2/20 0.41
▸ NPC1 O15118 1/20 0.41
▸ HPGD P15428 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ GAA P10253 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ KDM4C Q9H3R0 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ ADRA2A P08913 1/20 0.36

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
SCHEMBL2722654 0.76 HTT (0.48) HTTMAPTPDK1PDK2PDK3
SCHEMBL11405226 0.76 MAPT (0.48) HTTMAPTPDK1PDK2PDK3
SCHEMBL6681437 0.75 MAPT (0.42) HTTMAPTRAB9AHPGDALDH1A1
SCHEMBL29617680 0.75 MAPT (0.52) HTTMAPTRAB9ANPC1HPGD
SCHEMBL8984386 0.75 MAPT (0.52) HTTMAPTRAB9ANPC1HPGD
SCHEMBL21392300 0.74 PDK1 (0.49) HTTMAPTPDK1PDK2PDK3
SCHEMBL1430242 0.73 MAPT (0.50) HTTMAPTRAB9ANPC1HPGD
SCHEMBL1275442 0.72 PDK1 (0.47) HTTMAPTPDK1PDK2PDK3
SCHEMBL2031043 0.72 HDAC1 (0.42) HTTRAB9AHPGDALDH1A1MEN1
SCHEMBL11405089 0.71 MAPT (0.48) HTTMAPTRAB9ANPC1HPGD

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-20040235959-A1 Insecticidal diamides E. I. DU PONT DE NEMOURS AND COMPANY 2004-11-25 — — 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-20040235959-A1 Insecticidal diamides DDT, NRDC, NOXO1 HTT 4028/4885MAPT 4447/4885PDK1 4163/4885

“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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