SCHEMBL5013672

SCHEMBL5013672

Cc1nc(-c2ccccc2)oc1C(N)=O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.68
IKBKB O14920 3/20 0.59
KDM4E B2RXH2 5/20 0.54
HSD17B10 Q99714 3/20 0.54
PPARG P37231 1/20 0.54
NCOA2 Q15596 1/20 0.54
ALDH1A1 P00352 5/20 0.50
LMNA P02545 2/20 0.49
SLC9A1 P19634 1/20 0.46
DGAT1 O75907 1/20 0.45
DHODH Q02127 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
USP2 O75604 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
HTT P42858 1/20 0.43
TARBP2 Q15633 1/20 0.43
TP53 P04637 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
SCHEMBL2789941 0.88 GAA (0.73) GAAIKBKBKDM4EHSD17B10PPARG
Hydrochloric Acid SCHEMBL11623044 0.86 GAA (0.71) GAAIKBKBKDM4EHSD17B10PPARG
SCHEMBL11626804 0.85 IKBKB (0.55) GAAIKBKBKDM4EHSD17B10ALDH1A1
SCHEMBL20646882 0.85 GAA (0.69) GAAIKBKBKDM4EHSD17B10PPARG
SCHEMBL2775125 0.83 GAA (0.68) GAAIKBKBKDM4EHSD17B10PPARG
SCHEMBL11624706 0.83 GAA (0.76) GAAIKBKBKDM4EHSD17B10PPARG
SCHEMBL4741742 0.81 IKBKB (0.57) GAAIKBKBKDM4EHSD17B10PPARG
SCHEMBL11620116 0.81 GAA (0.78) GAAIKBKBKDM4EHSD17B10ALDH1A1
SCHEMBL20646881 0.81 GAA (0.64) GAAIKBKBKDM4EHSD17B10PPARG
SCHEMBL2778196 0.81 ALDH1A1 (0.74) GAAKDM4EHSD17B10ALDH1A1LMNA

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
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP claimed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US claimed
US-4072689-A ANTIINFLAMMATORY AGENTS GRUPPO LEPETIT S.P.A. (IT) 1978-02-07 US claimed
EP-1884513-A1 PYRAZOLE COMPOUND AND THERAPEUTIC AGENT FOR DIABETES COMPRISING THE SAME Japan Tobacco, Inc. (JP) 2008-02-06 EP disclosed
US-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents JAPAN TOBACCO INC. (JP) 2007-02-08 US disclosed
US-4072689-A ANTIINFLAMMATORY AGENTS GRUPPO LEPETIT S.P.A. (IT) 1978-02-07 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-20070032529-A1 Pyrazole compounds and their use as antidiabetes agents PYGL, GYS2, AGL GAA 53/4885IKBKB 2703/4885KDM4E 3446/4885

“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.