SCHEMBL24512908

SCHEMBL24512908

O=C(Nc1cc(-c2nc3ccccc3[nH]2)[nH]n1)c1ccccc1

nearest known ligand 0.80

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FOXO1 Q12778 13/20 0.80
ACHE P22303 1/20 0.70
PDE10A Q9Y233 3/20 0.66
NPC1 O15118 1/20 0.62
RAB9A P51151 1/20 0.62
MMP2 P08253 2/20 0.59
MMP9 P14780 2/20 0.59
MMP8 P22894 2/20 0.59
MMP13 P45452 2/20 0.59
COMT P21964 1/20 0.59

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
SCHEMBL22488739 0.92 FOXO1 (0.72) FOXO1ACHEPDE10ANPC1RAB9A
SCHEMBL25427295 0.91 FOXO1 (0.71) FOXO1ACHEPDE10AMMP2MMP9
SCHEMBL29524272 0.91 FOXO1 (0.71) FOXO1ACHEPDE10AMMP2MMP9
SCHEMBL25427870 0.88 FOXO1 (0.68) FOXO1ACHEPDE10ANPC1RAB9A
SCHEMBL29524651 0.88 FOXO1 (0.68) FOXO1ACHEPDE10ANPC1RAB9A
SCHEMBL29524264 0.88 FOXO1 (0.71) FOXO1ACHEPDE10ANPC1RAB9A
SCHEMBL25431631 0.88 FOXO1 (0.71) FOXO1ACHEPDE10ANPC1RAB9A
SCHEMBL25428325 0.88 FOXO1 (0.70) FOXO1ACHEPDE10ANPC1RAB9A
SCHEMBL30754018 0.88 FOXO1 (0.70) FOXO1ACHEPDE10ANPC1RAB9A
SCHEMBL25428627 0.87 FOXO1 (0.69) FOXO1ACHEPDE10ANPC1RAB9A

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-20220185797-A1 SELECTIVE FOXO INHIBITORS FOR TREATMENT OF DIABETES AND OTHER DISORDERS RELATED TO IMPAIRED PANCREATIC FUNCTION THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2022-06-16 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-20220185797-A1 SELECTIVE FOXO INHIBITORS FOR TREATMENT OF DIABETES AND OTHER DISORDERS RELATED TO IMPAIRED PANCREATIC FUNCTION FOXO1, FOXO3, FOXK1 FOXO1 1/4885ACHE 4176/4885PDE10A 2844/4885

“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.