SCHEMBL4812286

SCHEMBL4812286

N#CCCCOC(C(=O)NCc1ccccc1)C(O)C(N)Cc1cc(F)cc(F)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 5/20 0.37
SCN5A Q14524 4/20 0.37
CYP2D6 P10635 1/20 0.36
MCL1 Q07820 1/20 0.36
BACE1 P56817 2/20 0.35
BACE2 Q9Y5Z0 1/20 0.35
CTSS P25774 2/20 0.35
CTSK P43235 2/20 0.35
CTSB P07858 2/20 0.35
MMP8 P22894 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA3 P07451 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CACNA1C Q13936 1/20 0.34
CA9 Q16790 1/20 0.34

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
SCHEMBL8361891 0.75 BACE1 (0.63) BACE1BACE2CTSD
SCHEMBL8362475 0.75 BACE1 (0.37) BACE1BACE2CTSBCTSD
SCHEMBL4815708 0.75 BACE1 (0.63) BACE1BACE2CTSD
SCHEMBL4814122 0.75 LAP3 (0.39) CA12CA1CA2CA4CA9
SCHEMBL4812271 0.74 SCN5A (0.35) SCN9ASCN5ACYP2D6MCL1BACE1
SCHEMBL4811294 0.72 SCN9A (0.41) SCN9ASCN5ACYP2D6BACE1BACE2
SCHEMBL13333829 0.69 MASP2 (0.48) BACE1BACE2ANPEP
SCHEMBL14577806 0.69 MASP2 (0.48) BACE1BACE2ANPEP
SCHEMBL3356614 0.69 MASP2 (0.48) BACE1BACE2ANPEP
SCHEMBL4817387 0.66 LAP3 (0.47) BACE1CTSDANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7354943-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN (US) 2008-04-08 US claimed
US-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-28 US claimed
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-21 US claimed
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN 2003-05-01 US claimed
US-7358264-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN COMPANY (US) 2008-04-15 US disclosed
US-7354943-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN (US) 2008-04-08 US disclosed
US-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-28 US disclosed
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease ALZHEIMER'S COLLABORATION 2005-07-21 US disclosed
US-6864290-B2 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN, LLP (US) 2005-03-08 US disclosed
EP-1404328-A1 ALPHA-HYDROXYAMIDE STATINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-04-07 EP disclosed
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease PHARMACIA & UPJOHN 2003-05-01 US disclosed
WO-2003006021-A1 ALPHA-HYDROXYAMIDE STATINE DERIVATIVES FOR THE TREATMENT OF ALZH EIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2003-01-23 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 (3 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-20050165069-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN9A 2355/4885SCN5A 1457/4885CYP2D6 1050/4885
US-20050159459-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN9A 2355/4885SCN5A 1457/4885CYP2D6 1050/4885
US-20030083356-A1 Statine derivatives for the treatment of Alzheimer's disease BACE1, APP, BACE2 SCN9A 2386/4885SCN5A 1443/4885CYP2D6 1019/4885

“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.