SCHEMBL711692

SCHEMBL711692

CCOc1cc(OCc2ccc(S(C)(=O)=O)cc2)cc(-c2nc3ncccc3[nH]2)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 9/20 0.56
AURKA O14965 4/20 0.47
PDE5A O76074 2/20 0.45
PDE4A P27815 2/20 0.43
PDE4B Q07343 2/20 0.43
PDE4C Q08493 2/20 0.43
PDE4D Q08499 2/20 0.43
FGFR1 P11362 1/20 0.41
FGFR2 P21802 1/20 0.41
FGFR3 P22607 1/20 0.41
NPY5R Q15761 1/20 0.40
DHODH Q02127 1/20 0.39

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
SCHEMBL709335 0.90 PRMT5 (0.61) PRMT5AURKAPDE5APDE4APDE4B
SCHEMBL711172 0.86 PRMT5 (0.60) PRMT5AURKAPDE5APDE4APDE4B
SCHEMBL711302 0.82 PRMT5 (0.57) PRMT5AURKAPDE5APDE4APDE4B
SCHEMBL709311 0.80 AURKA (0.54) PRMT5AURKADHODH
SCHEMBL11770511 0.78 AURKA (0.62) PRMT5AURKA
SCHEMBL711323 0.76 AURKA (0.52) PRMT5AURKADHODH
SCHEMBL9635813 0.76 AURKA (0.54) PRMT5AURKAPDE5APDE4APDE4B
SCHEMBL711173 0.76 AURKA (0.56) PRMT5AURKAPDE5APDE4APDE4B
SCHEMBL9071891 0.74 GCK (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL711966 0.73 PRMT5 (0.67) PRMT5AURKAPDE5APDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-8124617-B2 Imidazopyridine compounds TAKEDA SAN DIEGO, INC. (US) 2012-02-28 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 US disclosed
US-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS TAKEDA SAN DIEGO, INC. 2010-03-18 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-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS GCK, GCKR, KHK PRMT5 2373/4885AURKA 1618/4885PDE5A 593/4885

“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.