SCHEMBL22489166

SCHEMBL22489166

O=C(Nc1cc(-c2nc3ccccc3[nH]2)n[nH]1)C1CCCCC1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FOXO1 Q12778 1/20 0.69
▸ NPC1 O15118 5/20 0.59
▸ RAB9A P51151 5/20 0.59
▸ SMN1; SMN2 Q16637 4/20 0.59
▸ POLB P06746 1/20 0.59
▸ TDP1 Q9NUW8 1/20 0.59
▸ S1PR1 P21453 1/20 0.57
▸ MAPT P10636 4/20 0.57
▸ ALDH1A1 P00352 4/20 0.57
▸ KDM4E B2RXH2 4/20 0.57
▸ HPGD P15428 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ WNT1 P04628 1/20 0.54
▸ PDPK1 O15530 3/20 0.54
▸ MEN1 O00255 2/20 0.52
▸ NPSR1 Q6W5P4 2/20 0.51
▸ LMNA P02545 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ CYP1A2 P05177 1/20 0.49

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
SCHEMBL24513595 0.81 FOXO1 (1.00) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL22489163 0.80 KDM4E (0.60) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL22489011 0.78 MMP2 (0.59) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL22488977 0.78 PDE10A (0.57) FOXO1NR2E3
SCHEMBL22489167 0.77 KDM4E (0.49) FOXO1SMN1; SMN2POLBMAPTALDH1A1
SCHEMBL13679582 0.77 TP53 (0.61) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL1646084 0.76 FOXO1 (0.62) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL27202465 0.76 NPC1 (0.71) FOXO1NPC1RAB9ASMN1; SMN2POLB
SCHEMBL22488979 0.76 NPC1 (0.61) FOXO1NPC1RAB9APOLBMAPT
SCHEMBL24513210 0.75 FOXO1 (0.71) FOXO1NPC1RAB9APOLBMAPT

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 2 patents. 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
WO-2020198351-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 (US) 2020-10-01 — — 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-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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