SCHEMBL24599951

SCHEMBL24599951

FC(F)(F)C(F)(F)C(F)(F)COc1ccc2ccccc2n1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
HDAC1 Q13547 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
CYSLTR2 Q9NS75 3/20 0.37
CYSLTR1 Q9Y271 3/20 0.37
PDE10A Q9Y233 2/20 0.36
CYP1A2 P05177 2/20 0.34
NCF1 P14598 1/20 0.34
NOS2 P35228 1/20 0.34
BACE1 P56817 1/20 0.34
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
CYP2C19 P33261 1/20 0.33

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
SCHEMBL6607250 0.83 MEN1 (0.51) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL12933385 0.77 MEN1 (0.51) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL28628097 0.74 MEN1 (0.56) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL6600702 0.74 MEN1 (0.56) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL24599908 0.72 AGXT (0.50) MEN1MAPTKMT2ACYP1A2CYP2C19
SCHEMBL9663555 0.71 MAPT (0.61) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL5255451 0.71 MAPT (0.46) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL2540903 0.71 SMN1; SMN2 (0.46) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL31325635 0.71 SMN1; SMN2 (0.46) MEN1MAPTKMT2AHDAC1HDAC8
SCHEMBL31531064 0.71 MEN1 (0.56) MEN1MAPTKMT2AHDAC1HDAC8

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-20220213039-A1 PYRIDINIUM SALTS AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2022-07-07 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-20220213039-A1 PYRIDINIUM SALTS AND PEST CONTROL AGENT ZYX, PNPO, PRDX1 MEN1 1530/4885MAPT 3721/4885KMT2A 913/4885

“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.