SCHEMBL6041646

SCHEMBL6041646

CC(C)(C)OC(=O)N1CC=C(C2=CC=C(OCc3ccccc3)NC2)CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GRM5 P41594 9/20 0.49
▸ GRM1 Q13255 9/20 0.49
▸ PDK4 Q16654 1/20 0.48
▸ NAMPT P43490 1/20 0.47
▸ HTR6 P50406 1/20 0.44
▸ GPR119 Q8TDV5 2/20 0.43
▸ WNT3A P56704 1/20 0.43
▸ TNK2 Q07912 1/20 0.42
▸ PDE10A Q9Y233 1/20 0.42

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
SCHEMBL6956024 0.85 GRM5 (0.35) GRM5GRM1PDK4NAMPT
SCHEMBL8195218 0.80 NAMPT (0.57) GRM5GRM1PDK4NAMPTHTR6
SCHEMBL23210245 0.79 PDK4 (0.60) GRM5GRM1PDK4NAMPTHTR6
SCHEMBL1366854 0.77 PDK4 (0.52) GRM5GRM1PDK4NAMPTHTR6
SCHEMBL31009246 0.77 PDK4 (0.52) GRM5GRM1PDK4NAMPTHTR6
SCHEMBL4006887 0.76 GRM1 (0.56) GRM5GRM1PDK4GPR119WNT3A
SCHEMBL15146264 0.76 GRM1 (0.56) GRM5GRM1PDK4NAMPTHTR6
SCHEMBL31444026 0.76 PDK4 (0.53) GRM5GRM1PDK4NAMPTHTR6
SCHEMBL31510790 0.76 NAMPT (0.52) GRM5GRM1PDK4NAMPTHTR6
SCHEMBL30913564 0.76 GRM1 (0.56) GRM5GRM1PDK4GPR119WNT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060079533-A1 Methods of treating alzheimer's disease NIEMAN JAMES A 2006-04-13 — — US disclosed
WO-2002076440-A2 METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES ELAN PHARMACEUTICALS, INC. (US) 2002-10-03 — — WO disclosed
US-6150526-A Piperidine derivative having renin inhibiting activity HOFFMANN-LA ROCHE INC. (US) 2000-11-21 — — US disclosed
US-6051712-A PREVENTION OF HIGH BLOOD PRESSURE AND CARDIAC INSUFFICIENCY, AS WELL AS GLAUCOMA, CARDIAC INFARCT, KIDNEY INSUFFICIENCY AND RESTENOSIS HOFFMANN-LA ROCHE INC. (US) 2000-04-18 — — 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-20060079533-A1 Methods of treating alzheimer's disease BACE1, PSEN1, PSEN2 GRM5 768/4885GRM1 572/4885PDK4 3371/4885

“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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