SCHEMBL3836841

SCHEMBL3836841

CC(C)(C)OC(=O)N1CCC2(CC1)N=C(c1ccc(Cl)cc1)C(=O)N2CC(=O)Nc1ccc(F)c(F)c1

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 12/20 0.58
TP53 P04637 5/20 0.58
ALDH1A1 P00352 3/20 0.53
HTT P42858 1/20 0.53
LMNA P02545 2/20 0.48
HPGD P15428 1/20 0.47
GAA P10253 1/20 0.46

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
SCHEMBL3840961 0.91 MAPT (0.57) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL13613790 0.85 MAPT (0.54) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL4912077 0.84 MAPT (0.80) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL21296573 0.83 MAPT (0.67) MAPTTP53ALDH1A1LMNAHPGD
SCHEMBL4521466 0.82 MAPT (0.66) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL4512973 0.82 MAPT (0.66) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL3218362 0.81 MAPT (0.61) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL3214415 0.81 MAPT (0.61) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL4508318 0.80 MAPT (0.64) MAPTTP53ALDH1A1HTTLMNA
SCHEMBL4518150 0.78 MAPT (0.55) MAPTTP53ALDH1A1HTTLMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325993-A1 GLYT1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders AHMAD NADIA MAMOONA 2009-12-31 US disclosed
US-20090325993-A1 GLYT1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders AHMAD NADIA MAMOONA 2009-12-31 US disclosed
EP-2108018-A2 8-OXA-1,4-DIAZASPIRO [4,5] DEC-3-EN-1-YL AND 1,4,8-TRIAZASPIRO [4,5] DEC-3-EN-1-YL ACETAMIDES AS GLYTI TRANSPORTER INHIBITORS IN TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS Glaxo Group Limited (GB) 2009-10-14 EP disclosed
WO-2008092877-A2 8-OXA-1, 4-DIAZASPIRO [4,5] DEC-3-EN-1-YL AND 1,4, 8-TRIAZASPIRO [4,5] DEC- 3-EN-1-YL ACETAMIDES AS GLYTI TRANSPORTER INHIBITORS IN TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2008-08-07 WO disclosed
WO-2008092877-A2 8-OXA-1, 4-DIAZASPIRO [4,5] DEC-3-EN-1-YL AND 1,4, 8-TRIAZASPIRO [4,5] DEC- 3-EN-1-YL ACETAMIDES AS GLYTI TRANSPORTER INHIBITORS IN TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2008-08-07 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-20090325993-A1 GLYT1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders SLC18A2, SLC1A2, SLC6A2 MAPT 92/4885TP53 3694/4885ALDH1A1 997/4885

“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.