SCHEMBL24513595

SCHEMBL24513595

O=C(Nc1cc(-c2nc3ccccc3[nH]2)[nH]n1)C1CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ FOXO1 Q12778 11/20 1.00
▸ NPC1 O15118 2/20 0.60
▸ RAB9A P51151 2/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ POLB P06746 1/20 0.60
▸ TDP1 Q9NUW8 1/20 0.60
▸ PDE10A Q9Y233 3/20 0.58
▸ S1PR1 P21453 1/20 0.58
▸ PDPK1 O15530 1/20 0.55
▸ ACHE P22303 1/20 0.55

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
SCHEMBL22489142 0.89 FOXO1 (0.80) FOXO1SMN1; SMN2PDE10APDPK1ACHE
SCHEMBL22489139 0.87 FOXO1 (0.77) FOXO1PDE10APDPK1ACHE
SCHEMBL22489135 0.87 FOXO1 (0.77) FOXO1SMN1; SMN2PDE10APDPK1ACHE
SCHEMBL22489136 0.85 FOXO1 (0.74) FOXO1NPC1RAB9ASMN1; SMN2PDE10A
SCHEMBL22489166 0.81 FOXO1 (0.69) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL24512908 0.79 FOXO1 (0.80) FOXO1NPC1RAB9APDE10AACHE
SCHEMBL30754034 0.78 FOXO1 (0.64) FOXO1PDE10AACHE
SCHEMBL25429204 0.78 FOXO1 (0.64) FOXO1PDE10AACHE
SCHEMBL4919646 0.78 FOXO1 (0.64) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL1646084 0.77 FOXO1 (0.62) FOXO1NPC1RAB9ASMN1; SMN2POLB

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 1/4885NPC1 3743/4885RAB9A 1948/4885

“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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