SCHEMBL2669132

SCHEMBL2669132

CN1CCOc2nc(Cl)c(F)cc2C1=O

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ALPL P05186 2/20 0.41
▸ LRRK2 Q5S007 2/20 0.39
▸ DGAT1 O75907 2/20 0.34
▸ KEAP1 Q14145 1/20 0.33
▸ NFE2L2 Q16236 1/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ GRM5 P41594 4/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ AR P10275 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ P2RX7 Q99572 1/20 0.30
▸ MAP3K14 Q99558 3/20 0.30

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
SCHEMBL2073931 0.75 PRMT5 (0.46) ALPLLRRK2DGAT1GRM5MEN1
SCHEMBL1775926 0.74 LRRK2 (0.42) ALPLLRRK2GRM5MEN1KMT2A
SCHEMBL2669109 0.71 GRM5 (0.36) ALPLLRRK2DGAT1KDM4EATM
SCHEMBL21603218 0.69 KEAP1 (0.39) KEAP1NFE2L2KDM4EGAAMAPK1
SCHEMBL1776612 0.69 NOTUM (0.37) ALPLLRRK2NTRK1GRM5MEN1
SCHEMBL19138410 0.69 ALPL (0.47) ALPLLRRK2DGAT1NTRK1KDM4E
SCHEMBL16984949 0.67 DGAT1 (0.44) DGAT1
SCHEMBL31597695 0.67 PKM (0.41) ALPLLRRK2GRM5MEN1KMT2A
SCHEMBL2072783 0.66 LRRK2 (0.45) ALPLLRRK2KDM4EATMGRM5
SCHEMBL3294692 0.65 GRM5 (0.34) KDM4EATMGRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110053910-A1 2 -HETEROCYCLYLOXYBENZOYL AMINO HETEROCYCLYL COMPOUNDS AS MODULATORS OF GLUCOKINASE FOR THE TREATMENT OF TYPE 2 DIABETES ASTRAZENECA AB (SE) 2011-03-03 — — US disclosed
US-20110053910-A1 2 -HETEROCYCLYLOXYBENZOYL AMINO HETEROCYCLYL COMPOUNDS AS MODULATORS OF GLUCOKINASE FOR THE TREATMENT OF TYPE 2 DIABETES ASTRAZENECA AB (SE) 2011-03-03 — — US disclosed
WO-2007007040-A1 2 -HETEROCYCLYLOXYBENZOYL AMINO HETEROCYCLYL COMPOUNDS AS MODULATORS OF GLUCOKINASE FOR THE TREATMENT OF TYPE 2 DIABETES ASTRAZENECA AB (SE) 2007-01-18 — — 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-20110053910-A1 2 -HETEROCYCLYLOXYBENZOYL AMINO HETEROCYCLYL COMPOUNDS AS MODULATORS OF GLUCOKINASE FOR THE TREATMENT OF TYPE 2 DIABETES GCK, GCKR, HK1 ALPL 4060/4885LRRK2 4008/4885DGAT1 450/4885

“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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