SCHEMBL711323

SCHEMBL711323

CS(=O)(=O)c1ccc(-c2cc(Oc3ccccc3)cc(-c3nc4ncccc4[nH]3)c2)cc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AURKA O14965 4/20 0.52
PRMT5 O14744 3/20 0.50
SCD O00767 3/20 0.47
CHEK2 O96017 1/20 0.45
FAAH O00519 1/20 0.45
GCK P35557 2/20 0.44
DHODH Q02127 1/20 0.43
NPBWR1 P48145 1/20 0.43

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
SCHEMBL709311 0.94 AURKA (0.54) AURKAPRMT5CHEK2FAAHGCK
SCHEMBL709335 0.88 PRMT5 (0.61) AURKAPRMT5GCKDHODH
SCHEMBL11770511 0.82 AURKA (0.62) AURKAPRMT5SCD
SCHEMBL711692 0.76 PRMT5 (0.56) AURKAPRMT5DHODH
SCHEMBL711966 0.73 PRMT5 (0.67) AURKAPRMT5FAAHDHODH
SCHEMBL4049683 0.72 SCD (0.62) AURKASCDNPBWR1
SCHEMBL10744375 0.72 AURKA (0.65) AURKAPRMT5
SCHEMBL4061729 0.71 AURKA (0.57) AURKASCD
SCHEMBL711173 0.70 AURKA (0.56) AURKAPRMT5FAAH
SCHEMBL3925926 0.69 AURKA (0.68) AURKAPRMT5CHEK2

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 7 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
WO-2007028135-A2 IMIDAZOPYRIDINE COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-03-08 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-20100069431-A1 IMIDAZOPYRIDINE COMPOUNDS GCK, GCKR, KHK AURKA 1618/4885PRMT5 2373/4885SCD 2937/4885

“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.