SCHEMBL2992061

SCHEMBL2992061

O=C1NC(=O)[C@@H]2C=CCC[C@H]12

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.33

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
SCHEMBL179776 1.00 BACE1 (0.33) BACE1
SCHEMBL2992065 1.00 BACE1 (0.33) BACE1
SCHEMBL2468842 0.98 BACE1 (0.32) BACE1
SCHEMBL2463994 0.98 BACE1 (0.32) BACE1
SCHEMBL31741298 0.98 BACE1 (0.32) BACE1
SCHEMBL2469139 0.98 BACE1 (0.32) BACE1
SCHEMBL2465935 0.98 BACE1 (0.32) BACE1
SCHEMBL2471188 0.98 BACE1 (0.32) BACE1
Propene SCHEMBL11784374 0.89
Carbamic Acid SCHEMBL9839794 0.89 ALDH1A1 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108752260-B Preparation method of mitiglinide calcium intermediate 江西济民可信药业有限公司 2021-07-27 CN disclosed
US-8198296-B2 Sub-type selective azabicycloalkane derivatives TARGACEPT, INC. (US) 2012-06-12 US disclosed
US-20100173968-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES TARGACEPT, INC. (US) 2010-07-08 US disclosed
WO-2005030718-A1 NOVEL METHOD OF PREPARING CIS-OCTAHYDRO-ISOINDOLE LES LABORATOIRES SERVIER (FR) 2005-04-07 WO disclosed
WO-2005030718-A1 NOVEL METHOD OF PREPARING CIS-OCTAHYDRO-ISOINDOLE LES LABORATOIRES SERVIER (FR) 2005-04-07 WO disclosed
US-4211861-A N,N*-BISIMIDE TECHNOCHEMIE GMBH VERFAHRENSTECHNIK (DE) 1980-07-08 US disclosed
US-4211860-A N,N*-BISMALEIMIDE TECHNOCHEMIE GMBH VERFAHRENSTECHNIK (DE) 1980-07-08 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-20100173968-A1 SUB-TYPE SELECTIVE AZABICYCLOALKANE DERIVATIVES CHRNB2, CHRNB4, CHRNA4 BACE1 1619/4885

“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.